Brightway Flows 1.0
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Ethanethiol

fo-de207f9e6d1eafd4

Identity

Type
Neutral molecule
CAS
75-08-1
EC
200-837-3
Origin
EF 3.1 hybrid_name_cas_v1
Changes
58 across every transformer

Structure

Structure diagram for Ethanethiol

What it is used for

2

Roles, not types. A substance bears as many as apply — sulfluramid is an insecticide and an acaricide — and each is a class ChEBI curates, asserted with ChEBI’s own has role. The narrow ones publish the broad ones alongside them, so a substance filed as a herbicide is a pesticide here too. See agricultural chemicals for what the axis is and which classes are published.

Role Definition Evidence
pesticide CHEBI:25944 Strictly, a substance intended to kill pests. In common usage, any substance used for controlling, preventing, or destroying animal, microbiological or plant pests. ChEBI
rodenticide CHEBI:33288 A substance used to destroy rodent pests. ChEBI

Alternative labels

17

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string DNJIEGIFACGWOD-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C2H6S/c1-2-3/h3H,2H2,1H3
IUPAC name chemrof:IUPAC_name Ethanethiol
Molecular formula chemrof:molecular_formula C2H6S
Molecular mass chemrof:molecular_mass 62.137
Monoisotopic mass chemrof:monoisotopic_mass 62.01902, 62.019021
SMILES string chemrof:smiles_string CCS

Known URLs

34

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
agr agr:IND44053261 enrich_references.chebi_xrefs
agr agr:IND606168645 enrich_references.chebi_xrefs
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=75-08-1 enrich_references.chebi_xrefs
cdc.gov https://www.cdc.gov/niosh-rtecs/KI92DDA8.html enrich_references.pubchem_identifier_url
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:46511 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.000.762 enrich_references.pubchem_identifier_url
chemicalsafety.ilo.org https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=0470 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID9026394 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=93877 enrich_references.pubchem_identifier_url
femaflavor.org https://www.femaflavor.org/flavor-library/ethanethiol enrich_references.pubchem_identifier_url
foodb.food foodb.food:FDB009365 enrich_references.chebi_xrefs
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/M439R54A1D enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0252004 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.439G enrich_references.pubchem_identifier_url
knapsack knapsack:C00050442 enrich_references.chebi_xrefs
MetaCyc https://metacyc.org/compound?orgid=META&id=CPD-10467 enrich_references.chebi_xrefs
ppdb ppdb:273 enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/6343 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#2363 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=110137 enrich_references.pubchem_identifier_url
PubMed https://pubmed.ncbi.nlm.nih.gov/24697436 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/24869921 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/25398287 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/25743944 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/26406878 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/27173572 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/28478709 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/28558212 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/30418102 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/30597355 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/32228376 enrich_references.chebi_xrefs
reaxys reaxys:773638 enrich_references.chebi_xrefs
Wikidata https://www.wikidata.org/wiki/Q407918 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Ethanethiol enrich_references.chebi_xrefs

Elementary flows

13
Flow Context Source Unit CFs
e2fa687c-6555-11dd-ad8b-0800200c9a66 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
08a91e70-3ddc-11dd-9345-0050c2490048 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
4f404c07-7789-493c-b1f1-9cff27d66ba6 Environmental → Air → Indoor EF 3.1 kg 4
08a91e70-3ddc-11dd-9344-0050c2490048 Environmental → Air → Long-term EF 3.1 kg 0
08a91e70-3ddc-11dd-9346-0050c2490048 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
08a91e70-3ddc-11dd-9343-0050c2490048 Environmental → Air → Unknown EF 3.1 kg 4
e2fa687a-6555-11dd-ad8b-0800200c9a66 Environmental → Ground → Agricultural EF 3.1 kg 4
e2fa687d-6555-11dd-ad8b-0800200c9a66 Environmental → Ground → Non-agricultural EF 3.1 kg 4
e2fa687f-6555-11dd-ad8b-0800200c9a66 Environmental → Ground → Unknown EF 3.1 kg 4
e2fa6881-6555-11dd-ad8b-0800200c9a66 Environmental → Water → Long-term EF 3.1 kg 0
e2fa687e-6555-11dd-ad8b-0800200c9a66 Environmental → Water → Ocean EF 3.1 kg 4
e2fa687b-6555-11dd-ad8b-0800200c9a66 Environmental → Water → Surface water EF 3.1 kg 4
e2fa6880-6555-11dd-ad8b-0800200c9a66 Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (58 changes)

Open the changes page

Full record

Flow object JSON 
{
  "flow_object_id": "fo-de207f9e6d1eafd4",
  "prefLabel": [
    {
      "@value": "Ethanethiol",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "1-ethanethiol",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "1-mercaptoethane",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "chebi_altlabels",
        "prov:wasAttributedTo": "consensus-flow-list",
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "Aethanethiol",
      "@language": "en",
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      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "Aethylmercaptan",
      "@language": "en",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "etantiolo",
      "@language": "en",
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      "provenance": {
        "prov:wasGeneratedBy": "chebi_altlabels",
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        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "ethyl hydrosulfide",
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        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "ethyl mercaptan",
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      "provenance": {
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    },
    {
      "@value": "ethyl sulfhydrate",
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      "provenance": {
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    },
    {
      "@value": "ethyl thioalcohol",
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      "provenance": {
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    },
    {
      "@value": "ethyl-mercaptan",
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    },
    {
      "@value": "etilmercaptano",
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    },
    {
      "@value": "mercaptan C2",
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    },
    {
      "@value": "mercaptoethane",
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    {
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    },
    {
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    },
    {
      "@value": "Thioethanol",
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    {
      "@value": "Thioethyl alcohol",
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