Triethyltin Bromide

Bromotriethylstannane
Bromotriethyltin
Stannane, bromotriethyl-
Tin, bromotriethyl-
Triethylstannyl bromide

Property	Value
InChI2D key string chemrof:inchi2d_key_string	KQPIFPBKXYBDGV-UHFFFAOYSA-M
InChI2D string chemrof:inchi2d_string	InChI=1S/3C2H5.BrH.Sn/c31-2;;/h31H2,2H3;1H;/q;;;;+1/p-1
IUPAC name chemrof:IUPAC_name	Triethyltin Bromide
Molecular formula chemrof:molecular_formula	C6H15BrSn
Molecular mass chemrof:molecular_mass	285.801
Monoisotopic mass chemrof:monoisotopic_mass	285.937907
SMILES string chemrof:smiles_string	C[CH2][Sn]([Br])([CH2]C)[CH2]C

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=2767-54-6	enrich_references.pubchem_identifier_url
chem.echa.europa.eu	https://chem.echa.europa.eu/100.018.585	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID9040712	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/UOP17166KC	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/17701	enrich_references.pubchem_compound
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/87071949	enrich_references.pubchem_compound
PubChem	https://pubchem.ncbi.nlm.nih.gov/erg/#3265	enrich_references.pubchem_identifier_url
Wikidata	https://www.wikidata.org/wiki/Q27291173	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
84cfdd73-3560-4134-a117-926af62155cc	Environmental → Air → Aircraft cruise height	EF 3.1	kg	2
314250fd-4ca5-4f89-90a3-777009db0ace	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	2
19f5505c-33e2-4d67-b941-4560f1e45b62	Environmental → Air → Indoor	EF 3.1	kg	2
ae380a31-9760-4837-aef1-b12e7aa0fd03	Environmental → Air → Long-term	EF 3.1	kg	0
34af1c12-bc03-46c7-b735-2c3b1afa5579	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	2
575cd7bf-588f-48e6-bbf8-e9d150be1bb7	Environmental → Air → Unknown	EF 3.1	kg	2
f326b0e5-d039-420d-bbc8-96b404c2a965	Environmental → Ground → Agricultural	EF 3.1	kg	2
2c82e759-824e-409f-a234-9b6996b4c6ed	Environmental → Ground → Non-agricultural	EF 3.1	kg	2
7b198a7f-6bf3-42b7-a7fd-13e6ce11fe5e	Environmental → Ground → Unknown	EF 3.1	kg	2
60749421-f353-4ec0-8e54-7020df5b5734	Environmental → Water → Long-term	EF 3.1	kg	0
c69d20d1-0523-423d-8834-224d880faeca	Environmental → Water → Ocean	EF 3.1	kg	2
416a090a-8919-46bb-9d82-a8e7d39b0b01	Environmental → Water → Surface water	EF 3.1	kg	2
604c6851-0ede-40e8-ab3d-073a5f55f5d1	Environmental → Water → Unknown	EF 3.1	kg	2

Everything that changed this substance (55 changes)

Open the changes page

Flow object JSON

{
  "flow_object_id": "fo-5d466ff7b0671c4f",
  "prefLabel": [
    {
      "@value": "Triethyltin Bromide",
      "@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": "Bromotriethylstannane",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:2767-54-6",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=2767-54-6"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Bromotriethyltin",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:2767-54-6",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=2767-54-6"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Stannane, bromotriethyl-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:2767-54-6",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=2767-54-6"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Tin, bromotriethyl-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:2767-54-6",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=2767-54-6"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Triethylstannyl bromide",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:2767-54-6",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=2767-54-6"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    }
  ],
  "properties": {
    "https://w3id.org/chemrof/molecular_formula": {
      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
        "C6H15BrSn"
      ],
      "attested_by": {
        "C6H15BrSn": [
          "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:17701",
            "CID:87071949"
          ],
          "prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C[CH2][Sn]([Br])([CH2]C)[CH2]C"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/inchi2d_key_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_key_string",
      "@value": [
        "KQPIFPBKXYBDGV-UHFFFAOYSA-M"
      ],
      "attested_by": {
        "KQPIFPBKXYBDGV-UHFFFAOYSA-M": [
          "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:17701",
            "CID:87071949"
          ],
          "prov:wasDerivedFrom": "pubchem.props.InChIKey"
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C[CH2][Sn]([Br])([CH2]C)[CH2]C"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "rdfs:label": "SMILES",
      "@value": [
        "C[CH2][Sn]([Br])([CH2]C)[CH2]C"
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "opsin_iupac",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "Triethyltin Bromide"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C[CH2][Sn]([Br])([CH2]C)[CH2]C"
          ]
        }
      ],
      "attested_by": {
        "C[CH2][Sn]([Br])([CH2]C)[CH2]C": [
          "opsin_iupac",
          "rdkit_post_consensus"
        ]
      }
    },
    "https://w3id.org/chemrof/inchi2d_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_string",
      "rdfs:label": "InChI",
      "@value": [
        "InChI=1S/3C2H5.BrH.Sn/c3*1-2;;/h3*1H2,2H3;1H;/q;;;;+1/p-1"
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "opsin_iupac",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "Triethyltin Bromide"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C[CH2][Sn]([Br])([CH2]C)[CH2]C"
          ]
        }
      ],
      "attested_by": {
        "InChI=1S/3C2H5.BrH.Sn/c3*1-2;;/h3*1H2,2H3;1H;/q;;;;+1/p-1": [
          "opsin_iupac",
          "rdkit_post_consensus"
        ]
      }
    },
    "https://w3id.org/chemrof/IUPAC_name": {
      "@id": "https://w3id.org/chemrof/IUPAC_name",
      "rdfs:label": "IUPAC name",
      "@value": [
        "Triethyltin Bromide"
      ],
      "provenance": {
        "prov:wasGeneratedBy": "opsin_iupac",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "Triethyltin Bromide"
        ]
      },
      "attested_by": {
        "Triethyltin Bromide": [
          "opsin_iupac"
        ]
      }
    },
    "https://w3id.org/chemrof/molecular_mass": {
      "@id": "https://w3id.org/chemrof/molecular_mass",
      "rdfs:label": "Molecular mass",
      "@value": [
        285.801
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "rdkit_pre_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CC[Sn+](CC)CC.[Br-]"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C[CH2][Sn]([Br])([CH2]C)[CH2]C"
          ]
        }
      ],
      "attested_by": {
        "285.801": [
          "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": [
        285.937907
      ],
      "provenance": [
        {
          "prov:wasGeneratedBy": "rdkit_pre_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CC[Sn+](CC)CC.[Br-]"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C[CH2][Sn]([Br])([CH2]C)[CH2]C"
          ]
        }
      ],
      "attested_by": {
        "285.937907": [
          "rdkit_post_consensus",
          "rdkit_pre_consensus"
        ]
      },
      "http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
    }
  },
  "references": [
    {
      "@id": "https://chem.echa.europa.eu/100.018.585",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:17701;CAS:2767-54-6"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[2767-54-6]"
      }
    },
    {
      "@id": "https://commonchemistry.cas.org/detail?cas_rn=2767-54-6",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:87071949;CAS:2767-54-6"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[2767-54-6]"
      }
    },
    {
      "@id": "https://comptox.epa.gov/dashboard/DTXSID9040712",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:17701;CAS:2767-54-6"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[2767-54-6]"
      }
    },
    {
      "@id": "https://gsrs.ncats.nih.gov/ginas/app/beta/substances/UOP17166KC",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:17701;CAS:2767-54-6"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[2767-54-6]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/compound/17701",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_compound",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:17701;CAS:2767-54-6"
        ],
        "prov:wasDerivedFrom": "pubchem.by_cas[2767-54-6]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/compound/87071949",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_compound",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:87071949;CAS:2767-54-6"
        ],
        "prov:wasDerivedFrom": "pubchem.by_cas[2767-54-6]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/erg/#3265",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:17701;CAS:2767-54-6"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[2767-54-6]"
      }
    },
    {
      "@id": "https://www.wikidata.org/wiki/Q27291173",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:17701;CAS:2767-54-6"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[2767-54-6]"
      }
    }
  ],
  "created_from": {
    "resolver": "hybrid_name_cas_v1",
    "seed_uuid": "19f5505c-33e2-4d67-b941-4560f1e45b62",
    "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": [
        "2767-54-6"
      ],
      "rdfs:seeAlso": [
        "https://commonchemistry.cas.org/detail?cas_rn=2767-54-6"
      ],
      "http://www.w3.org/2004/02/skos/core#exactMatch": [
        {
          "@id": "https://commonchemistry.cas.org/detail?cas_rn=2767-54-6"
        }
      ],
      "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": [
        "220-443-5"
      ],
      "rdfs:seeAlso": [
        "https://echa.europa.eu/search-for-chemicals?query=220-443-5"
      ],
      "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

Triethyltin Bromide

Identity

Structure

Alternative labels

Properties

Known URLs

Elementary flows

History

Full record

Something wrong here?

Keyboard