5-vinylbicyclo[2.2.1]hept-2-ene

2-Norbornene, 5-vinyl-
2-Vinyl-5-norbornene
2-Vinylbicyclo[2.2.1]hept-5-ene
2-Vinylnorbornene
5-Ethenylbicyclo[2.2.1]hept-2-ene
5-Vinyl-2-norbornene
5-Vinylnorbornene
6-Vinylbicyclo[2.2.1]hept-2-ene
Bicyclo[2.2.1]hept-2-ene, 5-ethenyl-
VBH
Vinylnorbornene

Property	Value
InChI2D key string chemrof:inchi2d_key_string	INYHZQLKOKTDAI-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C9H12/c1-2-8-5-7-3-4-9(8)6-7/h2-4,7-9H,1,5-6H2
IUPAC name chemrof:IUPAC_name	5-vinylbicyclo[2.2.1]hept-2-ene
Molecular formula chemrof:molecular_formula	C9H12
Molecular mass chemrof:molecular_mass	120.195
Monoisotopic mass chemrof:monoisotopic_mass	120.0939
SMILES string chemrof:smiles_string	C=CC1CC2C=CC1C2

Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.

Resource	URL	Recorded by
CAS Common Chemistry	https://commonchemistry.cas.org/detail?cas_rn=3048-64-4	enrich_references.pubchem_identifier_url
CAS Common Chemistry	https://commonchemistry.cas.org/detail?cas_rn=30604-01-4	enrich_references.pubchem_identifier_url
chem.echa.europa.eu	https://chem.echa.europa.eu/100.019.328	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID6029250	enrich_references.pubchem_identifier_url
dtp.cancer.gov	https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=61529	enrich_references.pubchem_identifier_url
ebi.ac.uk	https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3186510	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.819H	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/18273	enrich_references.pubchem_compound
Wikidata	https://www.wikidata.org/wiki/Q81984009	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
2a641c0b-b02e-40f5-857f-c8c41df8c42b	Environmental → Air → Aircraft cruise height	EF 3.1	kg	4
1b5f57ea-03bb-4ed4-8efa-4a088fe79965	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	4
459b8444-3285-4fd0-8e0c-79e2c5185a1a	Environmental → Air → Indoor	EF 3.1	kg	4
312b41ae-fdfe-4ef8-b900-6ba02e7a16e8	Environmental → Air → Long-term	EF 3.1	kg	0
e95cb235-b4f8-4c80-8444-9898d6560540	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	4
5b7990e0-d5ae-4ae0-9a9d-7c122af6dc6f	Environmental → Air → Unknown	EF 3.1	kg	4
20455aa9-c6be-4b59-911c-e9334c375388	Environmental → Ground → Agricultural	EF 3.1	kg	4
fdca582c-7342-43cf-ba67-d798122bc87c	Environmental → Ground → Non-agricultural	EF 3.1	kg	4
c666eb1e-684a-4eba-b1c3-cd9183a4c0d7	Environmental → Ground → Unknown	EF 3.1	kg	4
528a5855-818f-4cfa-bf2c-889a5ca00450	Environmental → Water → Long-term	EF 3.1	kg	0
091116ae-ea06-47b3-933c-4053aa74f3a6	Environmental → Water → Ocean	EF 3.1	kg	4
3d8235d8-c7d9-44f1-bf0a-453878c2d5b2	Environmental → Water → Surface water	EF 3.1	kg	4
e9d281a9-a757-40a3-8b6c-2a67b1d486c5	Environmental → Water → Unknown	EF 3.1	kg	4

Everything that changed this substance (54 changes)

Open the changes page

Flow object JSON

{
  "flow_object_id": "fo-0966a41ac3f5b6fe",
  "prefLabel": [
    {
      "@value": "5-vinylbicyclo[2.2.1]hept-2-ene",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "bootstrap_labels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "2-Norbornene, 5-vinyl-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:3048-64-4",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=3048-64-4"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2-Vinyl-5-norbornene",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:3048-64-4",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=3048-64-4"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2-Vinylbicyclo[2.2.1]hept-5-ene",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:3048-64-4",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=3048-64-4"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2-Vinylnorbornene",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:3048-64-4",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=3048-64-4"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "5-Ethenylbicyclo[2.2.1]hept-2-ene",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:3048-64-4",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=3048-64-4"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "5-Vinyl-2-norbornene",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:3048-64-4",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=3048-64-4"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "5-Vinylnorbornene",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:3048-64-4",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=3048-64-4"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "6-Vinylbicyclo[2.2.1]hept-2-ene",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:3048-64-4",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=3048-64-4"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Bicyclo[2.2.1]hept-2-ene, 5-ethenyl-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:3048-64-4",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=3048-64-4"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "VBH",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:3048-64-4",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=3048-64-4"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Vinylnorbornene",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:3048-64-4",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=3048-64-4"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    }
  ],
  "properties": {
    "https://w3id.org/chemrof/molecular_formula": {
      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
        "C9H12"
      ],
      "attested_by": {
        "C9H12": [
          "enrich_references.pubchem_semantic",
          "rdkit_post_consensus"
        ]
      },
      "rdfs:label": "Molecular formula",
      "provenance": [
        {
          "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CID:18273"
          ],
          "prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C=CC1CC2C=CC1C2"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/inchi2d_key_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_key_string",
      "@value": [
        "INYHZQLKOKTDAI-UHFFFAOYSA-N"
      ],
      "attested_by": {
        "INYHZQLKOKTDAI-UHFFFAOYSA-N": [
          "enrich_references.pubchem_semantic",
          "rdkit_post_consensus"
        ]
      },
      "rdfs:label": "InChIKey",
      "provenance": [
        {
          "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CID:18273"
          ],
          "prov:wasDerivedFrom": "pubchem.props.InChIKey"
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C=CC1CC2C=CC1C2"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "rdfs:label": "SMILES",
      "@value": [
        "C=CC1CC2C=CC1C2"
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "opsin_iupac",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "5-vinylbicyclo[2.2.1]hept-2-ene"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C=CC1CC2C=CC1C2"
          ]
        }
      ],
      "attested_by": {
        "C=CC1CC2C=CC1C2": [
          "opsin_iupac",
          "rdkit_post_consensus"
        ]
      }
    },
    "https://w3id.org/chemrof/inchi2d_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_string",
      "rdfs:label": "InChI",
      "@value": [
        "InChI=1S/C9H12/c1-2-8-5-7-3-4-9(8)6-7/h2-4,7-9H,1,5-6H2"
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "opsin_iupac",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "5-vinylbicyclo[2.2.1]hept-2-ene"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C=CC1CC2C=CC1C2"
          ]
        }
      ],
      "attested_by": {
        "InChI=1S/C9H12/c1-2-8-5-7-3-4-9(8)6-7/h2-4,7-9H,1,5-6H2": [
          "opsin_iupac",
          "rdkit_post_consensus"
        ]
      }
    },
    "https://w3id.org/chemrof/IUPAC_name": {
      "@id": "https://w3id.org/chemrof/IUPAC_name",
      "rdfs:label": "IUPAC name",
      "@value": [
        "5-vinylbicyclo[2.2.1]hept-2-ene"
      ],
      "provenance": {
        "prov:wasGeneratedBy": "opsin_iupac",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "5-vinylbicyclo[2.2.1]hept-2-ene"
        ]
      },
      "attested_by": {
        "5-vinylbicyclo[2.2.1]hept-2-ene": [
          "opsin_iupac"
        ]
      }
    },
    "https://w3id.org/chemrof/molecular_mass": {
      "@id": "https://w3id.org/chemrof/molecular_mass",
      "rdfs:label": "Molecular mass",
      "@value": [
        120.195
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "rdkit_pre_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C=CC1CC2CC1C=C2"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C=CC1CC2C=CC1C2"
          ]
        }
      ],
      "attested_by": {
        "120.195": [
          "rdkit_post_consensus",
          "rdkit_pre_consensus"
        ]
      },
      "http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
    },
    "https://w3id.org/chemrof/monoisotopic_mass": {
      "@id": "https://w3id.org/chemrof/monoisotopic_mass",
      "rdfs:label": "Monoisotopic mass",
      "@value": [
        120.0939
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "rdkit_pre_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C=CC1CC2CC1C=C2"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C=CC1CC2C=CC1C2"
          ]
        }
      ],
      "attested_by": {
        "120.0939": [
          "rdkit_post_consensus",
          "rdkit_pre_consensus"
        ]
      },
      "http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
    }
  },
  "references": [
    {
      "@id": "http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.819H",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:18273;CAS:3048-64-4"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[3048-64-4]"
      }
    },
    {
      "@id": "https://chem.echa.europa.eu/100.019.328",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:18273;CAS:3048-64-4"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[3048-64-4]"
      }
    },
    {
      "@id": "https://commonchemistry.cas.org/detail?cas_rn=3048-64-4",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:18273;CAS:3048-64-4"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[3048-64-4]"
      }
    },
    {
      "@id": "https://commonchemistry.cas.org/detail?cas_rn=30604-01-4",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:18273;CAS:3048-64-4"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[3048-64-4]"
      }
    },
    {
      "@id": "https://comptox.epa.gov/dashboard/DTXSID6029250",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:18273;CAS:3048-64-4"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[3048-64-4]"
      }
    },
    {
      "@id": "https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=61529",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:18273;CAS:3048-64-4"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[3048-64-4]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/compound/18273",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_compound",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:18273;CAS:3048-64-4"
        ],
        "prov:wasDerivedFrom": "pubchem.by_cas[3048-64-4]"
      }
    },
    {
      "@id": "https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3186510",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:18273;CAS:3048-64-4"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[3048-64-4]"
      }
    },
    {
      "@id": "https://www.wikidata.org/wiki/Q81984009",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:18273;CAS:3048-64-4"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[3048-64-4]"
      }
    }
  ],
  "created_from": {
    "resolver": "hybrid_name_cas_v1",
    "seed_uuid": "091116ae-ea06-47b3-933c-4053aa74f3a6",
    "seed_source": "EF 3.1",
    "semantic_typing": {
      "rule": "neutral_molecule",
      "reason": "",
      "types": [
        "https://w3id.org/chemrof/NeutralMolecule"
      ],
      "provenance": {
        "prov:wasGeneratedBy": "semantic_typing.classify",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:wasDerivedFrom": "semantic_typing.rule.neutral_molecule"
      }
    }
  },
  "classifications": {
    "http://semanticscience.org/resource/CHEMINF_000446": {
      "@value": [
        "3048-64-4"
      ],
      "rdfs:seeAlso": [
        "https://commonchemistry.cas.org/detail?cas_rn=3048-64-4"
      ],
      "http://www.w3.org/2004/02/skos/core#exactMatch": [
        {
          "@id": "https://commonchemistry.cas.org/detail?cas_rn=3048-64-4"
        }
      ],
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "cas_numbers"
      }
    },
    "http://semanticscience.org/resource/CHEMINF_000447": {
      "@value": [
        "221-259-8"
      ],
      "rdfs:seeAlso": [
        "https://echa.europa.eu/search-for-chemicals?query=221-259-8"
      ],
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "ec_numbers"
      }
    }
  },
  "origin_qualifier": null,
  "parent_flow_object_id": null,
  "parent_intervention_id": null,
  "@type": [
    "https://w3id.org/chemrof/NeutralMolecule"
  ]
}

You do not need to run a build or clone anything. Name the record and say what your evidence is; the measurement is done for you. How contributing works

5-vinylbicyclo[2.2.1]hept-2-ene

Identity

Structure

Alternative labels

Properties

Known URLs

Elementary flows

History

Full record

Something wrong here?

Keyboard