Consensus flow list

Identity

Type
Neutral molecule
CAS
299-86-5
EC
206-083-1
Origin
EF 3.1 hybrid_name_cas_v1
Changes
56 across every transformer

Structure

Structure diagram for Crufomate

Alternative labels

12

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string BOFHKBLZOYVHSI-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C12H19ClNO3P/c1-12(2,3)9-6-7-11(10(13)8-9)17-18(15,14-4)16-5/h6-8H,1-5H3,(H,14,15)
IUPAC name chemrof:IUPAC_name 4-tert-Butyl-2-chlorophenyl methyl N-methylphosphoramidate
Molecular formula chemrof:molecular_formula C12H19ClNO3P
Molecular mass chemrof:molecular_mass 291.715
Monoisotopic mass chemrof:monoisotopic_mass 291.079108, 291.07911
SMILES string chemrof:smiles_string CNP(=O)(OC)Oc1ccc(C(C)(C)C)cc1Cl

Known URLs

20

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=299-86-5 enrich_references.chebi_xrefs
cdc.gov https://www.cdc.gov/niosh-rtecs/TB3ABF10.html enrich_references.pubchem_identifier_url
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:82111 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.005.531 enrich_references.pubchem_identifier_url
chemicalsafety.ilo.org https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=1143 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID1037515 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=253463 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1880767 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/V82Q65924L enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J5.472K enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C18972 enrich_references.chebi_xrefs
KEGG https://www.genome.jp/entry/D03610 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C18972 enrich_references.pubchem_identifier_url
kegg.jp https://www.kegg.jp/entry/D03610 enrich_references.pubchem_identifier_url
ncithesaurus.nci.nih.gov https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C75214 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/9300 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#2783 enrich_references.pubchem_identifier_url
vsdb vsdb:1276 enrich_references.chebi_xrefs
wikidata.org https://www.wikidata.org/wiki/Q20983235 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Crufomate enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
fe6ee813-5837-4c33-bc81-45d4ff8b75ef Environmental → Air → Aircraft cruise height EF 3.1 kg 4
26d56364-d487-421f-84d3-729ef5ee6967 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
d6e9818f-a7eb-4bb8-b95a-c7c208eaf7db Environmental → Air → Indoor EF 3.1 kg 4
741816bc-2f50-4c4d-81cc-26e601b04e2f Environmental → Air → Long-term EF 3.1 kg 0
783b729d-c39f-4ee7-b0ef-2e728ff9f0f8 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
f42258eb-0da8-4219-a5fb-4d4d8a66dfd3 Environmental → Air → Unknown EF 3.1 kg 4
c0dd1e99-9205-47f7-aec5-8eeb1bc57b1d Environmental → Ground → Agricultural EF 3.1 kg 4
21b7d24b-7e78-4b91-a5db-3222c81a985b Environmental → Ground → Non-agricultural EF 3.1 kg 4
09ed7564-2a9e-4f28-9180-f6b3afa60cc2 Environmental → Ground → Unknown EF 3.1 kg 4
455b1b90-1079-48ca-b6e3-418a96829860 Environmental → Water → Long-term EF 3.1 kg 0
ca3f8de7-5d66-48ed-9153-e8f051505d11 Environmental → Water → Ocean EF 3.1 kg 4
404ef0e4-354b-4b0b-a51e-83af724bfafa Environmental → Water → Surface water EF 3.1 kg 4
1f4be3be-1b76-42e1-8f28-e27614b36a1b 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
{
  "flow_object_id": "fo-0116f3714cee25b2",
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      }
    }
  ],
  "altLabel": [
    {
      "@value": "4-tert-Butyl-2-chlorophenyl methyl methylphosphoramidate",
      "@language": "en",
      "@lang": "en",
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      }
    },
    {
      "@value": "4-tert-Butyl-2-chlorophenyl N-methyl O-methylphosphoramidate",
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    },
    {
      "@value": "Amidofos",
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      "@value": "Crufomat",
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    },
    {
      "@value": "Ruelene",
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