Brightway Flows 1.0
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Triethylammonium

fo-f6e3745421d1a03e

Identity

Type
Molecular cation
CAS
17440-81-2
EC
—
Origin
ecoinvent-3.12 hybrid_name_cas_v1
Changes
0 across every transformer

Structure

Structure diagram for Triethylammonium

Alternative labels

8

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 1
InChI2D key string chemrof:inchi2d_key_string ZMANZCXQSJIPKH-UHFFFAOYSA-O
InChI2D string chemrof:inchi2d_string InChI=1S/C6H15N/c1-4-7(5-2)6-3/h4-6H2,1-3H3/p+1
IUPAC name chemrof:IUPAC_name Triethylammonium
Molecular formula chemrof:molecular_formula C6H16N, C6H16N+
Molecular mass chemrof:molecular_mass 102.201
Monoisotopic mass chemrof:monoisotopic_mass 102.127726, 102.12773
SMILES string chemrof:smiles_string CC[NH+](CC)CC

Known URLs

5

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
beilstein beilstein:10775110 enrich_references.chebi_xrefs
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=17440-81-2 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:45791 enrich_references.chebi_id_link
gmelin gmelin:26284 enrich_references.chebi_xrefs
pdb-ccd pdb-ccd:TEA enrich_references.chebi_xrefs

Elementary flows

1
Flow Context Source Unit CFs
fdd592ae755e4fc10f53ea03700fca9d2fce7581 Environmental → Water → Unknown ecoinvent algorithm addition kg 0

History

Everything that changed this substance (0 changes)

Open the changes page

Full record

Flow object JSON 
{
  "flow_object_id": "fo-f6e3745421d1a03e",
  "prefLabel": [
    {
      "@value": "Triethylammonium",
      "@language": "en",
      "@lang": "en",
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        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "N,N-diethylethanaminium",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "TEAH",
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "TRIETHYLAMMONIUM ION",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "Triethylammonium cation",
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        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "N,N,N-Triethylammonium cation",
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        ],
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    },
    {
      "@value": "Ethanamine, N,N-diethyl-, conjugate acid",
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    },
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  "references": [
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    "semantic_typing": {
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      "types": [
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  },
  "classifications": {
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      "@value": [
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  "origin_qualifier": null,
  "parent_flow_object_id": null,
  "parent_intervention_id": null,
  "http://www.w3.org/2004/02/skos/core#definition": [
    {
      "@value": "An organoammonium cation having three ethyl substituents on the nitrogen atom.",
      "@language": "en",
      "provenance": {
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      }
    }
  ],
  "@type": [
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  ]
}

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