Consensus flow list

Identity

Type
Neutral molecule
CAS
936-49-2
EC
213-313-4
Origin
EF 3.1 hybrid_name_cas_v1
Changes
54 across every transformer

Structure

Structure diagram for 2-phenyl-4,5-dihydro-1h-imidazole

Alternative labels

13

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string BKCCAYLNRIRKDJ-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C9H10N2/c1-2-4-8(5-3-1)9-10-6-7-11-9/h1-5H,6-7H2,(H,10,11)
IUPAC name chemrof:IUPAC_name 2-phenyl-4,5-dihydro-1h-imidazole
Molecular formula chemrof:molecular_formula C9H10N2
Molecular mass chemrof:molecular_mass 146.193
Monoisotopic mass chemrof:monoisotopic_mass 146.084398
SMILES string chemrof:smiles_string c1ccc(C2=NCCN2)cc1

Known URLs

10

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=936-49-2 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.012.103 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID5061322 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=54747 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL274548 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/E78R99DCH8 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J103.142B enrich_references.pubchem_identifier_url
pharos.nih.gov https://pharos.nih.gov/ligands/FB4D7ARY324Y enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/13639 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q63392122 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
4379f74f-5473-4585-a564-2f1821f19a0d Environmental → Air → Aircraft cruise height EF 3.1 kg 2
0c70b48b-a2e7-4ef8-a2ec-298a468743ee Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
472aa1c0-78cd-41fa-89c4-4d98656944d4 Environmental → Air → Indoor EF 3.1 kg 2
c8b73c55-56f9-494a-8508-2a40629424b6 Environmental → Air → Long-term EF 3.1 kg 0
61f1cf74-a82a-4df8-8425-32307066553e Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
6707221d-309b-4355-89d0-5edcf3a4d4e4 Environmental → Air → Unknown EF 3.1 kg 2
8fed13e2-138c-43d6-89e5-1d748e425c91 Environmental → Ground → Agricultural EF 3.1 kg 2
83407e54-44d8-4235-8516-11e97883a216 Environmental → Ground → Non-agricultural EF 3.1 kg 2
5772ea54-9bec-494d-82e5-c5df19059f49 Environmental → Ground → Unknown EF 3.1 kg 2
729c3c6b-4aac-426e-8f12-0daf9b20a5e7 Environmental → Water → Long-term EF 3.1 kg 0
997c68be-87a2-4050-a655-77190cea5ea2 Environmental → Water → Ocean EF 3.1 kg 2
0679ede9-5913-4c3d-a80e-c24f3a3407f4 Environmental → Water → Surface water EF 3.1 kg 2
4b39cfd8-9831-4435-bbc0-25ebfbdc8e90 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
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        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "cas_numbers"
      }
    },
    "http://semanticscience.org/resource/CHEMINF_000447": {
      "@value": [
        "213-313-4"
      ],
      "rdfs:seeAlso": [
        "https://echa.europa.eu/search-for-chemicals?query=213-313-4"
      ],
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "ec_numbers"
      }
    }
  },
  "origin_qualifier": null,
  "parent_flow_object_id": null,
  "parent_intervention_id": null,
  "@type": [
    "https://w3id.org/chemrof/NeutralMolecule"
  ]
}

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