Consensus flow list

Identity

Type
NeutralMolecule
CAS
1982-47-4
EC
217-843-7
Origin
EF 3.1 hybrid_name_cas_v1
Changes
58 across every transformer

Structure

Structure diagram for Chloroxuron

What it is used for

2

Roles, not types. A substance bears as many as apply — sulfluramid is an insecticide and an acaricide — and each is a class ChEBI curates, asserted with ChEBI’s own has role. The narrow ones publish the broad ones alongside them, so a substance filed as a herbicide is a pesticide here too. See agricultural chemicals for what the axis is and which classes are published.

Role Definition Evidence
herbicide CHEBI:24527 A substance used to destroy plant pests. ChEBI
pesticide CHEBI:25944 Strictly, a substance intended to kill pests. In common usage, any substance used for controlling, preventing, or destroying animal, microbiological or plant pests. ChEBI

Alternative labels

14

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string IVUXTESCPZUGJC-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C15H15ClN2O2/c1-18(2)15(19)17-12-5-9-14(10-6-12)20-13-7-3-11(16)4-8-13/h3-10H,1-2H3,(H,17,19)
IUPAC name chemrof:IUPAC_name 3-[4-(4-chlorophenoxy)phenyl]-1,1-dimethylurea
Molecular formula chemrof:molecular_formula C15H15ClN2O2
Molecular mass chemrof:molecular_mass 290.75
Monoisotopic mass chemrof:monoisotopic_mass 290.082205, 290.08221
SMILES string chemrof:smiles_string CN(C)C(=O)Nc1ccc(Oc2ccc(Cl)cc2)cc1

Known URLs

21

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
agr agr:IND43875696 enrich_references.chebi_xrefs
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=1982-47-4 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:82200 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.016.222 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID7040287 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1568699 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/QER23C88ME enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0250129 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.694C enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C19075 enrich_references.chebi_xrefs
pesticides pesticides:chloroxuron enrich_references.chebi_xrefs
ppdb ppdb:152 enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/16115 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#3077 enrich_references.pubchem_identifier_url
PubMed https://pubmed.ncbi.nlm.nih.gov/16628565 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/4074937 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/5736463 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/7518 enrich_references.chebi_xrefs
reaxys reaxys:2814275 enrich_references.chebi_xrefs
wikidata.org https://www.wikidata.org/wiki/Q2964148 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Chloroxuron enrich_references.chebi_xrefs

Elementary flows

14
Flow Context Source Unit CFs
e96bb2a0-b82b-4935-96ec-7619e55e2871 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
9b41e6a1-add5-4a62-883e-476d4f5d9841 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
50cfcc29-15b3-4104-b0bb-aa31bfd0bbec Environmental → Air → Indoor EF 3.1 kg 2
f9c4776f-168e-43c7-945c-9485b5940c8f Environmental → Air → Long-term EF 3.1 kg 0
34f56f01-56ab-43ae-9c6f-f37bccd5e10c Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
af13ff7e-2561-4815-9a09-6ebab471921a Environmental → Air → Unknown EF 3.1 kg 2
ee66c7fd-9a70-4272-8956-cba819735cf7 Environmental → Ground → Agricultural EF 3.1 kg 2
02b541d1-284a-4550-9570-f95014a495e9 Environmental → Ground → Non-agricultural EF 3.1 kg 2
442fca486dd4ef30b70a1f5c7eddc964305a37cc Environmental → Ground → Silvicultural ecoinvent algorithm addition kg 0
5ff210b7-181c-45c8-8332-cb0355d90cb7 Environmental → Ground → Unknown EF 3.1 kg 2
4a9bb034-80d2-4454-b2c5-95fcb0b8f58c Environmental → Water → Long-term EF 3.1 kg 0
d69356ea-61e8-434a-98ea-212f9d78a9e2 Environmental → Water → Ocean EF 3.1 kg 2
a80b168f-2327-49a1-98fb-a4b29329f06a Environmental → Water → Surface water EF 3.1 kg 2
64a62f8e-4a83-497e-976a-ef469bf3f8fe Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (58 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-0b246b5468468bee",
  "prefLabel": [
    {
      "@value": "Chloroxuron",
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  "altLabel": [
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