Consensus flow list

Identity

Type
NeutralMolecule
CAS
6746-94-7
EC
425-430-1
Origin
EF 3.1 hybrid_name_cas_v1
Changes
54 across every transformer

Structure

Structure diagram for Ethynyl Cyclopropane

Alternative labels

6

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string NPTDXPDGUHAFKC-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C5H6/c1-2-5-3-4-5/h1,5H,3-4H2
IUPAC name chemrof:IUPAC_name Ethynyl Cyclopropane
Molecular formula chemrof:molecular_formula C5H6
Molecular mass chemrof:molecular_mass 66.103
Monoisotopic mass chemrof:monoisotopic_mass 66.04695
SMILES string chemrof:smiles_string C#CC1CC1

Known URLs

9

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=6746-94-7 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.102.389 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.120.716 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID80217795 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/CYA9F6WH2T enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J798.432D enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/138823 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q13506985 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Cyclopropylacetylene enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
e7e67ce4-d8a7-4892-812d-1ee440cf2d4a Environmental → Air → Aircraft cruise height EF 3.1 kg 2
1d94c2d6-2e51-4f56-bf2d-d3f96641347b Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
4e0ef1d2-4c98-432b-9a36-a6ce89399a57 Environmental → Air → Indoor EF 3.1 kg 2
eb260f22-6c0b-4394-a320-524e8491e808 Environmental → Air → Long-term EF 3.1 kg 0
293b6450-bd53-4e4e-bd8d-0161e902f677 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
9df4c15c-77bd-4b67-ad8b-3dca5e0455a7 Environmental → Air → Unknown EF 3.1 kg 2
6cf7ac75-31df-41de-b945-8470799cff5f Environmental → Ground → Agricultural EF 3.1 kg 2
bd29fab5-a3f5-4fea-ade1-f6a9de7bdfca Environmental → Ground → Non-agricultural EF 3.1 kg 2
b7c14c8e-bc45-469d-b2ff-5435c81700e9 Environmental → Ground → Unknown EF 3.1 kg 2
d8ea7ed0-cd97-4942-bf2e-079fb605380c Environmental → Water → Long-term EF 3.1 kg 0
f9b7e457-999b-4534-bfff-723f6ed0491d Environmental → Water → Ocean EF 3.1 kg 2
90a3191f-2a66-4ba0-a300-0eb7001833bb Environmental → Water → Surface water EF 3.1 kg 2
409bb152-af43-4939-8653-9229e94ec3b8 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (54 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-1892ad166791f089",
  "prefLabel": [
    {
      "@value": "Ethynyl Cyclopropane",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "Acetylene, cyclopropyl-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Cyclopropane, ethynyl-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Cyclopropylacetylene",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Cyclopropylethyne",
      "@language": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
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    },
    {
      "@value": "Ethyne, cyclopropyl-",
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    {
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    "https://w3id.org/chemrof/monoisotopic_mass": {
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}

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