Consensus flow list

5,5-dimethylhydantoin

fo-dc479a4ff81a1250

Identity

Type
Neutral molecule
CAS
77-71-4
EC
201-051-3
Origin
EF 3.1 hybrid_name_cas_v1
Changes
56 across every transformer

Structure

Structure diagram for 5,5-dimethylhydantoin

Alternative labels

8

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string YIROYDNZEPTFOL-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C5H8N2O2/c1-5(2)3(8)6-4(9)7-5/h1-2H3,(H2,6,7,8,9)
IUPAC name chemrof:IUPAC_name 5,5-dimethylhydantoin
Molecular formula chemrof:molecular_formula C5H8N2O2
Molecular mass chemrof:molecular_mass 128.131
Monoisotopic mass chemrof:monoisotopic_mass 128.058577, 128.05858
SMILES string chemrof:smiles_string CC1(C)NC(=O)NC1=O

Known URLs

13

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=77-71-4 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:183672 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.000.957 enrich_references.pubchem_identifier_url
ChemSpider https://www.chemspider.com/Chemical-Structure.6246.html enrich_references.chebi_xrefs
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID5021754 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=8652 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3181806 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/34032MQ9RO enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J25.257C enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/D77989 enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/6491 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q27256302 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/5,5-Dimethylhydantoin enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
9ea255ca-69e1-416f-8667-504ea1a116b2 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
f4043482-24cf-4217-9af5-dc77f8c7c1ce Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
1ea186c1-774f-4a99-8e3f-20c4852e1b7d Environmental → Air → Indoor EF 3.1 kg 4
5a407d71-8607-4ade-8ec4-c9570622bbb6 Environmental → Air → Long-term EF 3.1 kg 0
b19a5bc6-31cf-4316-801d-3c0ecd12b634 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
89372cd7-eedb-4fd5-a7b3-4d39bc8a1148 Environmental → Air → Unknown EF 3.1 kg 4
440c554d-da4c-4014-8839-a1ceba7dba52 Environmental → Ground → Agricultural EF 3.1 kg 4
3dba348b-84e2-4bbf-aad8-04fe7f3397af Environmental → Ground → Non-agricultural EF 3.1 kg 4
73d4916b-568c-4832-a461-54819b90f3f7 Environmental → Ground → Unknown EF 3.1 kg 4
d1675e56-2678-477c-bd29-5d7389ac9519 Environmental → Water → Long-term EF 3.1 kg 0
ea9dd87f-389c-400a-bfe5-bab8a0965529 Environmental → Water → Ocean EF 3.1 kg 4
2d2b9ef3-0a28-4f0f-b25d-dd1075f27d21 Environmental → Water → Surface water EF 3.1 kg 4
d16cc290-eddc-46c7-bc3b-e5a7f6b6b30b Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (56 changes)

Open the changes page

Full record

Flow object JSON 
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    "seed_uuid": "1ea186c1-774f-4a99-8e3f-20c4852e1b7d",
    "seed_source": "EF 3.1",
    "semantic_typing": {
      "rule": "neutral_molecule",
      "reason": "",
      "types": [
        "https://w3id.org/chemrof/NeutralMolecule"
      ],
      "provenance": {
        "prov:wasGeneratedBy": "semantic_typing.classify",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:wasDerivedFrom": "semantic_typing.rule.neutral_molecule"
      }
    }
  },
  "classifications": {
    "http://semanticscience.org/resource/CHEMINF_000446": {
      "@value": [
        "77-71-4"
      ],
      "rdfs:seeAlso": [
        "https://commonchemistry.cas.org/detail?cas_rn=77-71-4"
      ],
      "http://www.w3.org/2004/02/skos/core#exactMatch": [
        {
          "@id": "https://commonchemistry.cas.org/detail?cas_rn=77-71-4"
        }
      ],
      "provenance": {
        "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": [
        "201-051-3"
      ],
      "rdfs:seeAlso": [
        "https://echa.europa.eu/search-for-chemicals?query=201-051-3"
      ],
      "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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