Consensus flow list

Identity

Type
Neutral molecule
CAS
288-32-4
EC
206-019-2
Origin
EF 3.1 hybrid_name_cas_v1
Changes
57 across every transformer

Structure

Structure diagram for Imidazole

Alternative labels

16

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string RAXXELZNTBOGNW-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C3H4N2/c1-2-5-3-4-1/h1-3H,(H,4,5)
IUPAC name chemrof:IUPAC_name Imidazole
Molecular formula chemrof:molecular_formula C3H4N2
Molecular mass chemrof:molecular_mass 68.079
Monoisotopic mass chemrof:monoisotopic_mass 68.037448, 68.03745
SMILES string chemrof:smiles_string c1c[nH]cn1

Known URLs

28

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=227760-40-9 enrich_references.pubchem_identifier_url
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=288-32-4 enrich_references.chebi_xrefs
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=82370-43-2 enrich_references.pubchem_identifier_url
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:16069 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.005.473 enrich_references.pubchem_identifier_url
chemicalsafety.ilo.org https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=1721 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID2029616 enrich_references.pubchem_identifier_url
drugbank.ca https://www.drugbank.ca/drugs/DB03366 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=60522 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL540 enrich_references.pubchem_identifier_url
gmelin gmelin:1417 enrich_references.chebi_xrefs
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/7GBN705NH1 enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0001525 enrich_references.chebi_xrefs
hts.usitc.gov https://hts.usitc.gov/search?query=2933.29.60.00 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.566F enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C01589 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C01589 enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=37848 enrich_references.pubchem_identifier_url
patent patent:US3255200 enrich_references.chebi_xrefs
pdb-ccd pdb-ccd:IMD enrich_references.chebi_xrefs
platform.opentargets.org https://platform.opentargets.org/drug/CHEMBL540 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/795 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#3263 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=008702 enrich_references.pubchem_identifier_url
PubMed https://pubmed.ncbi.nlm.nih.gov/9730817 enrich_references.chebi_xrefs
reaxys reaxys:103853 enrich_references.chebi_xrefs
wikidata.org https://www.wikidata.org/wiki/Q328692 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Imidazole enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
bda903d9-4a19-4fe2-a651-c4614ffe66bb Environmental → Air → Aircraft cruise height EF 3.1 kg 4
8dc9b025-e96d-4668-a9b5-959a74be0b37 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
fd935512-d39c-4d8f-99f2-d6f14994f8a3 Environmental → Air → Indoor EF 3.1 kg 4
1c3c3ada-10b7-4657-87fe-5abe2120e48c Environmental → Air → Long-term EF 3.1 kg 0
6d5e92ae-8be7-445c-a19e-6f0986e8f09d Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
1da74c04-6667-47ac-8158-d7e30cd29f89 Environmental → Air → Unknown EF 3.1 kg 4
8c4e0889-72da-4317-b21b-f0f80f4564cf Environmental → Ground → Agricultural EF 3.1 kg 4
e5dc6fa9-4993-4a57-9c4f-7a08a478c121 Environmental → Ground → Non-agricultural EF 3.1 kg 4
1f2cbe7e-4fe4-45b1-82be-d6ed6fc480e1 Environmental → Ground → Unknown EF 3.1 kg 4
cb44a8a8-17f0-4dc0-b62a-58bf03c1b9f6 Environmental → Water → Long-term EF 3.1 kg 0
0c759571-1e11-4751-a42d-211de49337a5 Environmental → Water → Ocean EF 3.1 kg 4
4ea46ec7-ea62-4063-846d-653fa5ce5762 Environmental → Water → Surface water EF 3.1 kg 4
9ee4fd5e-48ea-4388-a970-118bce5cc7ed Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (57 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-891d6d628f51620c",
  "prefLabel": [
    {
      "@value": "Imidazole",
      "@language": "en",
      "@lang": "en",
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        "prov:hadPrimarySource": [
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        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "1,3-diaza-2,4-cyclopentadiene",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "1,3-Diazole",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "1H-imidazole",
      "@language": "en",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "3-Azapyrrole",
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    },
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    },
    {
      "@value": "Imidazol",
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    },
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    },
    {
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    },
    {
      "@value": "Methanimidamide, N,N′-1,2-ethenediyl-",
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    },
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    },
    {
      "@value": "N,N'-1,2-ethenediylmethanimidamide",
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    },
    {
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  "references": [
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