Consensus flow list

Identity

Type
Neutral molecule
CAS
1746-81-2
EC
217-129-5
Origin
EF 3.1 hybrid_name_cas_v1
Changes
56 across every transformer

Structure

Structure diagram for Monolinuron

Alternative labels

14

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string LKJPSUCKSLORMF-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C9H11ClN2O2/c1-12(14-2)9(13)11-8-5-3-7(10)4-6-8/h3-6H,1-2H3,(H,11,13)
IUPAC name chemrof:IUPAC_name 1-Methoxy-1-methyl-3-(4-chlorophenyl)urea
Molecular formula chemrof:molecular_formula C9H11ClN2O2
Molecular mass chemrof:molecular_mass 214.652
Monoisotopic mass chemrof:monoisotopic_mass 214.050905, 214.05091
SMILES string chemrof:smiles_string CON(C)C(=O)Nc1ccc(Cl)cc1

Known URLs

15

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=1746-81-2 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:81965 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.015.572 enrich_references.pubchem_identifier_url
chemicalsafety.ilo.org https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=1273 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID0037576 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1320234 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/6KJJ4XAD6M enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0254863 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J7.766F enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C18794 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C18794 enrich_references.pubchem_identifier_url
ppdb ppdb:475 enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/15629 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q6901670 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Monolinuron enrich_references.pubchem_identifier_url

Elementary flows

14
Flow Context Source Unit CFs
1f30d653-6556-11dd-ad8b-0800200c9a66 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
08a91e70-3ddc-11dd-96b9-0050c2490048 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
d17e39a6-3c5d-40f5-8c0f-c05464451bf0 Environmental → Air → Indoor EF 3.1 kg 2
08a91e70-3ddc-11dd-96b8-0050c2490048 Environmental → Air → Long-term EF 3.1 kg 0
08a91e70-3ddc-11dd-96ba-0050c2490048 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
08a91e70-3ddc-11dd-96b7-0050c2490048 Environmental → Air → Unknown EF 3.1 kg 2
08a91e70-3ddc-11dd-96b5-0050c2490048 Environmental → Ground → Agricultural EF 3.1 kg 2
fe0acd60-3ddc-11dd-a9d7-0050c2490048 Environmental → Ground → Non-agricultural EF 3.1 kg 2
baeeda081012e54e17d2274e23d3d2b9dc3613e1 Environmental → Ground → Silvicultural ecoinvent algorithm addition kg 0
08a91e70-3ddc-11dd-96b6-0050c2490048 Environmental → Ground → Unknown EF 3.1 kg 2
08a91e70-3ddc-11dd-96bc-0050c2490048 Environmental → Water → Long-term EF 3.1 kg 0
fe0acd60-3ddc-11dd-aa74-0050c2490048 Environmental → Water → Ocean EF 3.1 kg 2
08a91e70-3ddc-11dd-96bb-0050c2490048 Environmental → Water → Surface water EF 3.1 kg 2
08a91e70-3ddc-11dd-96bd-0050c2490048 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (56 changes)

Open the changes page

Full record

Flow object JSON
{
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