Isofetamid
fo-a2d33ff50ff91be4
Identity
- Type
- Neutral molecule
- CAS
- 875915-78-9
- EC
- 694-975-5
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 58 across every transformer
Structure
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- 2-Thiophenecarboxamide, N-[1,1-dimethyl-2-[2-methyl-4-(1-methylethoxy)phenyl]-2-oxoethyl]-3-methyl-
- 3-methyl-n-{2-methyl-1-[2-methyl-4-(propan-2-yloxy)phenyl]-1-oxopropan-2-yl}thiophene-2-carboxamide
- Kenja
- Kenja 400SC
- Kenja 400SC Fungicide
- Kenja FL
- N-[1,1-dimethyl-2-(4-isopropoxy-o-tolyl)-2-oxoethyl]-3-methylthiophene-2-carboxamide
- N-[1,1-dimethyl-2-[2-methyl-4-(1-methylethoxy)phenyl]-2-oxoethyl]-3-methyl-2-thiophenecarboxamide
- N-[1-(4-isopropoxy-2-methylphenyl)-2-methyl-1-oxopropan-2-yl]-3-methylthiophene-2-carboxamide
- Saifenxianjuntong
Properties
| Property | Value |
|---|---|
| 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
11Where 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 | 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)
Full record
Flow object JSON
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Something wrong here?
- This substance is published under the wrong name
- This is not that chemical
- This record is two substances, or it is a second copy of one
You do not need to run a build or clone anything. Name the record and say what your evidence is; the measurement is done for you. How contributing works