Consensus flow list

Isofetamid

fo-a2d33ff50ff91be4

Identity

Type
NeutralMolecule
CAS
875915-78-9
EC
694-975-5
Origin
EF 3.1 hybrid_name_cas_v1
Changes
58 across every transformer

Structure

Structure diagram for Isofetamid

What it is used for

3

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
agrochemical CHEBI:33286 An agrochemical is a substance that is used in agriculture or horticulture. ChEBI
fungicide CHEBI:24127 A substance used to destroy fungal 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

10

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string WMKZDPFZIZQROT-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C20H25NO3S/c1-12(2)24-15-7-8-16(14(4)11-15)18(22)20(5,6)21-19(23)17-13(3)9-10-25-17/h7-12H,1-6H3,(H,21,23)
IUPAC name chemrof:IUPAC_name N-[1,1-dimethyl-2-(4-isopropoxy-o-tolyl)-2-oxoethyl]-3-methylthiophene-2-carboxamide
Molecular formula chemrof:molecular_formula C20H25NO3S
Molecular mass chemrof:molecular_mass 359.491
Monoisotopic mass chemrof:monoisotopic_mass 359.15551, 359.155515
SMILES string chemrof:smiles_string Cc1cc(OC(C)C)ccc1C(=O)C(C)(C)NC(=O)c1sccc1C

Known URLs

11

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=875915-78-9 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:83065 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.223.286 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID50893848 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/95499Z1H0H enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.839.207I enrich_references.pubchem_identifier_url
pesticides pesticides:isofetamid enrich_references.chebi_xrefs
ppdb ppdb:2781 enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/71657865 enrich_references.pubchem_compound
reaxys reaxys:11931431 enrich_references.chebi_xrefs
wikidata.org https://www.wikidata.org/wiki/Q19286296 enrich_references.pubchem_identifier_url

Elementary flows

14
Flow Context Source Unit CFs
9d2b38d3-26ff-4c1c-984f-0c5e595fd6fd Environmental → Air → Aircraft cruise height EF 3.1 kg 4
9ac38523-b47d-4722-8d9c-1cd1bc1f604f Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
042e8557-6f8a-4049-9bda-6927ba3282ae Environmental → Air → Indoor EF 3.1 kg 4
86e00729-1681-4879-b311-0f04d69a1907 Environmental → Air → Long-term EF 3.1 kg 0
9d41fafd-af72-44d7-8d32-185d7e20a393 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
385e7633-ce47-4fb8-9349-a980302c79cd Environmental → Air → Unknown EF 3.1 kg 4
cc6b5c09-ed56-44cb-b1c9-0f73aa848b89 Environmental → Ground → Agricultural EF 3.1 kg 4
0040be11-989d-44fb-8dd4-e4711d665b8b Environmental → Ground → Non-agricultural EF 3.1 kg 4
ea95599d2a64dfefd7af26f752210430bcfec2d3 Environmental → Ground → Silvicultural ecoinvent algorithm addition kg 0
afaf7131-35d7-4fba-8f6f-4a882be960ba Environmental → Ground → Unknown EF 3.1 kg 4
d6af3301-deed-4780-bc5e-1255b2633890 Environmental → Water → Long-term EF 3.1 kg 0
7266c699-6185-4a91-a44f-a259d1d69891 Environmental → Water → Ocean EF 3.1 kg 4
bf8f1236-c211-4373-99c5-393129f4df05 Environmental → Water → Surface water EF 3.1 kg 4
f6c27a98-ccb1-4d38-956a-773e9b43eedc Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (58 changes)

Open the changes page

Full record

Flow object JSON 
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