Consensus flow list

Identity

Type
NeutralMolecule
CAS
644-64-4
EC
211-420-0
Origin
EF 3.1 hybrid_name_cas_v1
Changes
57 across every transformer

Structure

Structure diagram for Dimetilan

What it is used for

1

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
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

13

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string RDBIYWSVMRVKSG-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C10H16N4O3/c1-7-6-8(17-10(16)13(4)5)11-14(7)9(15)12(2)3/h6H,1-5H3
IUPAC name chemrof:IUPAC_name [1-(dimethylcarbamoyl)-5-methylpyrazol-3-yl] N,N-dimethylcarbamate
Molecular formula chemrof:molecular_formula C10H16N4O3
Molecular mass chemrof:molecular_mass 240.263
Monoisotopic mass chemrof:monoisotopic_mass 240.12224
SMILES string chemrof:smiles_string Cc1cc(OC(=O)N(C)C)nn1C(=O)N(C)C

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=644-64-4 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:233357 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.010.383 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID2041880 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3183014 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/S53KQ82I35 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J62.073D enrich_references.pubchem_identifier_url
ncithesaurus.nci.nih.gov https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C163650 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/12572 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#2757 enrich_references.pubchem_identifier_url
PubMed https://pubmed.ncbi.nlm.nih.gov/7968576 enrich_references.chebi_xrefs
wikidata.org https://www.wikidata.org/wiki/Q5277351 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Dimetilan enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
e9b301ec-9fc3-4daf-9959-d903ef9552dd Environmental → Air → Aircraft cruise height EF 3.1 kg 2
6b4ef5e6-b1a4-4935-a9d0-ce5c98c9bca2 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
b41513fa-7f3a-4906-97ad-c6f5dd05ff15 Environmental → Air → Indoor EF 3.1 kg 2
65bf60db-6c8c-4f6b-a22f-2a88b9f83f67 Environmental → Air → Long-term EF 3.1 kg 0
1c30f886-6b37-42ed-a04a-6ae8131e7f89 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
9ab11d08-83b5-454b-b40d-4c9d3fe89405 Environmental → Air → Unknown EF 3.1 kg 2
5be9f27f-0086-458a-9e94-cfaf2eb3b788 Environmental → Ground → Agricultural EF 3.1 kg 2
29387ddb-c29c-43ad-b373-cc9b526e6f51 Environmental → Ground → Non-agricultural EF 3.1 kg 2
e6d6615b-b706-4a7b-b96e-5db865482893 Environmental → Ground → Unknown EF 3.1 kg 2
8729abb4-090b-422b-868a-1a384b011344 Environmental → Water → Long-term EF 3.1 kg 0
c5c12c4f-bb33-42de-9a54-bc9026f62295 Environmental → Water → Ocean EF 3.1 kg 2
9de1cc95-d477-429f-98ff-8e2c8256da20 Environmental → Water → Surface water EF 3.1 kg 2
fbd1ae94-6a57-42a0-b3a7-e993d78b1161 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (57 changes)

Open the changes page

Full record

Flow object JSON
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