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Triethylaluminum

fo-5fdec5316f78540b

Identity

Type
Neutral molecule
CAS
97-93-8
EC
202-619-3
Origin
EF 3.1 hybrid_name_cas_v1
Changes
55 across every transformer

Structure

Structure diagram for Triethylaluminum

Alternative labels

4

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string VOITXYVAKOUIBA-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/3C2H5.Al/c3*1-2;/h3*1H2,2H3;
IUPAC name chemrof:IUPAC_name Triethylaluminum
Molecular formula chemrof:molecular_formula C6H15Al
Molecular mass chemrof:molecular_mass 114.168
Monoisotopic mass chemrof:monoisotopic_mass 114.098914
SMILES string chemrof:smiles_string C[CH2][Al]([CH2]C)[CH2]C

Known URLs

8

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=97-93-8 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.002.382 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID6026616 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/H426E9H3TT enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J9.911B enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/16682930 enrich_references.pubchem_compound
Wikidata https://www.wikidata.org/wiki/Q416298 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Triethylaluminium enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
213957ef-5447-4456-a3c6-da40f11def4c Environmental → Air → Aircraft cruise height EF 3.1 kg 4
7d25d4a5-7c09-472c-ab70-073a6dad89b1 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
da2816a5-9f3b-42a0-a69a-4e61197a6b0e Environmental → Air → Indoor EF 3.1 kg 4
3e1f4b53-9cda-4ab1-a839-fa7783c6f6c0 Environmental → Air → Long-term EF 3.1 kg 0
286c9494-367f-406c-b166-53d2209f7774 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
c7dc0b0f-7410-47c0-8f6f-5378690a5e56 Environmental → Air → Unknown EF 3.1 kg 4
51ebd317-b65e-4ea4-bfa8-d8d9ece7a602 Environmental → Ground → Agricultural EF 3.1 kg 4
cde5433e-0e2a-4035-8261-9fa74e7d17b1 Environmental → Ground → Non-agricultural EF 3.1 kg 4
27c44548-db7a-4b39-9199-89194164ad50 Environmental → Ground → Unknown EF 3.1 kg 4
00540781-f199-4d79-b40a-2d53eb0b33d3 Environmental → Water → Long-term EF 3.1 kg 0
3411c55a-cb40-4105-a0f6-de7eac509169 Environmental → Water → Ocean EF 3.1 kg 4
29460f89-fcdc-46ac-8899-56be3d07cb57 Environmental → Water → Surface water EF 3.1 kg 4
bd43e88d-fdde-4ad1-8ee4-ff39d104f309 Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (55 changes)

Open the changes page

Full record

Flow object JSON 
{
  "flow_object_id": "fo-5fdec5316f78540b",
  "prefLabel": [
    {
      "@value": "Triethylaluminum",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "Aluminum, triethyl-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=97-93-8"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "TEAL",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:hadPrimarySource": [
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          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=97-93-8"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Triethylalane",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
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          "https://commonchemistry.cas.org/detail?cas_rn=97-93-8"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Triethylaluminium",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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          "https://commonchemistry.cas.org/detail?cas_rn=97-93-8"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    }
  ],
  "properties": {
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      "@value": [
        "C6H15Al"
      ],
      "attested_by": {
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          "rdkit_post_consensus"
        ]
      },
      "rdfs:label": "Molecular formula",
      "provenance": [
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          "prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
        },
        {
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      "rdfs:label": "InChIKey",
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        }
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    },
    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "rdfs:label": "SMILES",
      "@value": [
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      ],
      "provenance": [
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        },
        {
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          "prov:hadPrimarySource": [
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          ]
        }
      ],
      "attested_by": {
        "C[CH2][Al]([CH2]C)[CH2]C": [
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          "rdkit_post_consensus"
        ]
      }
    },
    "https://w3id.org/chemrof/inchi2d_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_string",
      "rdfs:label": "InChI",
      "@value": [
        "InChI=1S/3C2H5.Al/c3*1-2;/h3*1H2,2H3;"
      ],
      "provenance": [
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          ]
        },
        {
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          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
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          ]
        }
      ],
      "attested_by": {
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          "rdkit_post_consensus"
        ]
      }
    },
    "https://w3id.org/chemrof/IUPAC_name": {
      "@id": "https://w3id.org/chemrof/IUPAC_name",
      "rdfs:label": "IUPAC name",
      "@value": [
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      ],
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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        ]
      },
      "attested_by": {
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        ]
      }
    },
    "https://w3id.org/chemrof/molecular_mass": {
      "@id": "https://w3id.org/chemrof/molecular_mass",
      "rdfs:label": "Molecular mass",
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      ],
      "provenance": [
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          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CC[Al](CC)CC"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C[CH2][Al]([CH2]C)[CH2]C"
          ]
        }
      ],
      "attested_by": {
        "114.168": [
          "rdkit_post_consensus",
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      },
      "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": [
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      ],
      "provenance": [
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          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
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          "prov:hadPrimarySource": [
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          ]
        }
      ],
      "attested_by": {
        "114.098914": [
          "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=J9.911B",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
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        ],
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    },
    {
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      }
    },
    {
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      "provenance": {
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      }
    },
    {
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      }
    },
    {
      "@id": "https://gsrs.ncats.nih.gov/ginas/app/beta/substances/H426E9H3TT",
      "provenance": {
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        "prov:wasDerivedFrom": "pubchem.by_cas[97-93-8]"
      }
    },
    {
      "@id": "https://www.wikidata.org/wiki/Q416298",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
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        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[97-93-8]"
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    }
  ],
  "created_from": {
    "resolver": "hybrid_name_cas_v1",
    "seed_uuid": "00540781-f199-4d79-b40a-2d53eb0b33d3",
    "seed_source": "EF 3.1",
    "semantic_typing": {
      "rule": "neutral_molecule",
      "reason": "",
      "types": [
        "https://w3id.org/chemrof/NeutralMolecule"
      ],
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
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      }
    }
  },
  "classifications": {
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      "@value": [
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      "rdfs:seeAlso": [
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      ],
      "http://www.w3.org/2004/02/skos/core#exactMatch": [
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      ],
      "provenance": {
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        "prov:wasDerivedFrom": "ec_numbers"
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    }
  },
  "origin_qualifier": null,
  "parent_flow_object_id": null,
  "parent_intervention_id": null,
  "@type": [
    "https://w3id.org/chemrof/NeutralMolecule"
  ]
}

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