Brightway Flows 1.0
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5-amino-6-methyl-1,3-dihydrobenzoimidazol-2-one

fo-8cbb7aa6dc8d9103

Identity

Type
Neutral molecule
CAS
67014-36-2
EC
428-410-9
Origin
EF 3.1 hybrid_name_cas_v1
Changes
54 across every transformer

Structure

Structure diagram for 5-amino-6-methyl-1,3-dihydrobenzoimidazol-2-one

Alternative labels

3

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string ZCXIPVIGYBHUTQ-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C8H9N3O/c1-4-2-6-7(3-5(4)9)11-8(12)10-6/h2-3H,9H2,1H3,(H2,10,11,12)
IUPAC name chemrof:IUPAC_name 5-amino-6-methyl-1,3-dihydrobenzoimidazol-2-one
Molecular formula chemrof:molecular_formula C8H9N3O
Molecular mass chemrof:molecular_mass 163.18
Monoisotopic mass chemrof:monoisotopic_mass 163.074562
SMILES string chemrof:smiles_string Cc1cc2[nH]c(=O)[nH]c2cc1N

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=67014-36-2 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.102.679 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.123.900 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID10985859 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=525609 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/47864WO7J3 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.590.475E enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/352271 enrich_references.pubchem_compound
Wikidata https://www.wikidata.org/wiki/Q72439131 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
e8d2d1b6-b275-4646-aee1-7c990d5e6a2f Environmental → Air → Aircraft cruise height EF 3.1 kg 4
d59cc3f9-b21b-474b-ad91-c0ee2f059497 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
f53f4d6a-cff0-4c68-8778-dff5d3d50cfe Environmental → Air → Indoor EF 3.1 kg 4
3e9e7c89-6e5f-4346-91a4-1829661c3597 Environmental → Air → Long-term EF 3.1 kg 0
efc0f517-1c5f-4fda-961a-64ef124f2309 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
b2066def-c008-4b09-969c-38a148d38cd9 Environmental → Air → Unknown EF 3.1 kg 4
f1c8417e-3d56-4491-84be-10d3f34b5532 Environmental → Ground → Agricultural EF 3.1 kg 4
a585a236-1061-46a4-8ddb-735c5b6ea281 Environmental → Ground → Non-agricultural EF 3.1 kg 4
5947abc8-ee0f-4a06-bdcc-fd0dd8e4a270 Environmental → Ground → Unknown EF 3.1 kg 4
d61190b7-ab78-47f5-b00d-0a3eb07d9099 Environmental → Water → Long-term EF 3.1 kg 0
b7df35bc-b1c5-451d-bdd4-4a023711ef72 Environmental → Water → Ocean EF 3.1 kg 4
cf5f908a-91ca-40f5-9628-76147802a257 Environmental → Water → Surface water EF 3.1 kg 4
cf9bff43-627d-4591-9c2c-b22a2e3190cf Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (54 changes)

Open the changes page

Full record

Flow object JSON 
{
  "flow_object_id": "fo-8cbb7aa6dc8d9103",
  "prefLabel": [
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      "@language": "en",
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        "prov:hadPrimarySource": [
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        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "2H-Benzimidazol-2-one, 5-amino-1,3-dihydro-6-methyl-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:hadPrimarySource": [
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "5-Amino-1,3-dihydro-6-methyl-2H-benzimidazol-2-one",
      "@language": "en",
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        ],
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      }
    },
    {
      "@value": "5-Amino-6-methyl-2-benzimidazolone",
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    "https://w3id.org/chemrof/monoisotopic_mass": {
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}

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