Consensus flow list

Identity

Type
Neutral molecule
CAS
927-74-2
EC
213-161-9
Origin
EF 3.1 hybrid_name_cas_v1
Changes
57 across every transformer

Structure

Structure diagram for But-3-yn-1-ol

Alternative labels

12

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string OTJZCIYGRUNXTP-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C4H6O/c1-2-3-4-5/h1,5H,3-4H2
IUPAC name chemrof:IUPAC_name But-3-yn-1-ol
Molecular formula chemrof:molecular_formula C4H6O
Molecular mass chemrof:molecular_mass 70.091
Monoisotopic mass chemrof:monoisotopic_mass 70.04186, 70.041865
SMILES string chemrof:smiles_string C#CCCO

Known URLs

16

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=927-74-2 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:27444 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.011.966 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID1022136 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=9708 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/P74L430293 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.744B enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C06146 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C06146 enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=51319 enrich_references.pubchem_identifier_url
patent patent:CH680439 enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/13566 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=551099 enrich_references.pubchem_identifier_url
PubMed https://pubmed.ncbi.nlm.nih.gov/17434192 enrich_references.chebi_xrefs
reaxys reaxys:773710 enrich_references.chebi_xrefs
wikidata.org https://www.wikidata.org/wiki/Q223060 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
cb48b762-6204-4002-a222-a035955ba9c0 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
f3b05210-9887-4f8d-8a89-1af7e4f0f7c4 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
ccd8b2eb-2c98-4782-92ca-2c00c1759da9 Environmental → Air → Indoor EF 3.1 kg 2
f4b1b949-1305-450c-a51c-ba8fd38ab863 Environmental → Air → Long-term EF 3.1 kg 0
641f4be1-da9a-42ab-9b4a-d1122bab813b Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
60846e79-b9e6-4416-b7e8-b1a8a0042128 Environmental → Air → Unknown EF 3.1 kg 2
bab14edf-fd2e-4345-ab79-19d7a72d783b Environmental → Ground → Agricultural EF 3.1 kg 2
e417a4bd-a5a9-4068-84ef-6d45d04cfb46 Environmental → Ground → Non-agricultural EF 3.1 kg 2
7e0a3561-b188-4e1d-b226-cda69417f98d Environmental → Ground → Unknown EF 3.1 kg 2
3557b5a3-5865-4d2f-aae8-9af476473565 Environmental → Water → Long-term EF 3.1 kg 0
258b5741-721f-48ce-abac-3fe86d66eaba Environmental → Water → Ocean EF 3.1 kg 2
dc986b7a-64d5-434d-88e4-b9d46691bcaa Environmental → Water → Surface water EF 3.1 kg 2
9ab81b6d-df08-45f5-8a09-ca72c8bae11d Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (57 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-77411be6edab1b09",
  "prefLabel": [
    {
      "@value": "But-3-yn-1-ol",
      "@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": "(2-Hydroxyethyl)acetylene",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:hadPrimarySource": [
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "1-butyn-4-ol",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "chebi_altlabels",
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "1-Hydroxy-3-butyne",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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      }
    },
    {
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "3-Butyn-1-yl alcohol",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
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    },
    {
      "@value": "3-butynyl alcohol",
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      }
    },
    {
      "@value": "4-hydroxy-1-butyne",
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    },
    {
      "@value": "4-hydroxy-but-1-yne",
      "@language": "en",
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      "provenance": {
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        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "Butan-3-yne-1-ol",
      "@language": "en",
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      "provenance": {
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        ],
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      }
    },
    {
      "@value": "ethynylmethyl carbinol",
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      "provenance": {
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    },
    {
      "@value": "homopropargyl alcohol",
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    "https://w3id.org/chemrof/inchi2d_string": {
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      "rdfs:label": "InChI",
      "@value": [
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}

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