Tritosulfuron
fo-d04110ba7071e37f
Identity
- Type
- Neutral molecule
- CAS
- 142469-14-5
- EC
- 604-291-0
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 59 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 |
|---|---|---|
| environmental contaminant CHEBI:78298 | Any minor or unwanted substance introduced into the environment that can have undesired effects. | ChEBI |
| 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
7- 1-[4-methoxy-6-(trifluoromethyl)-1,3,5-triazin-2-yl]-3-[2-(trifluoromethyl)benzenesulfonyl]urea
- 1-[4-methoxy-6-(trifluoromethyl)-1,3,5-triazin-2-yl]-3-[2-(trifluoromethyl)benzenesulfonyl]urea (containing ≤ 0,02% Amtt)
- Benzenesulfonamide, N-[[[4-methoxy-6-(trifluoromethyl)-1,3,5-triazin-2-yl]amino]carbonyl]-2-(trifluoromethyl)-
- Biathlon
- LAB 271272
- N-[[[4-Methoxy-6-(trifluoromethyl)-1,3,5-triazin-2-yl]amino]carbonyl]-2-(trifluoromethyl)benzenesulfonamide
- N-{[4-methoxy-6-(trifluoromethyl)-1,3,5-triazin-2-yl]carbamoyl}-2-(trifluoromethyl)benzenesulfonamide
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | KVEQCVKVIFQSGC-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C13H9F6N5O4S/c1-28-11-21-8(13(17,18)19)20-9(23-11)22-10(25)24-29(26,27)7-5-3-2-4-6(7)12(14,15)16/h2-5H,1H3,(H2,20,21,22,23,24,25) |
| IUPAC name chemrof:IUPAC_name | 1-[4-methoxy-6-(trifluoromethyl)-1,3,5-triazin-2-yl]-3-[2-(trifluoromethyl)benzenesulfonyl]urea |
| Molecular formula chemrof:molecular_formula | C13H9F6N5O4S |
| Molecular mass chemrof:molecular_mass | 445.301 |
| Monoisotopic mass chemrof:monoisotopic_mass | 445.02794, 445.027944 |
| SMILES string chemrof:smiles_string | COc1nc(NC(=O)NS(=O)(=O)c2ccccc2C(F)(F)F)nc(C(F)(F)F)n1 |
Known URLs
19Where 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=142469-14-5 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:83500 | enrich_references.chebi_id_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.106.874 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID9057975 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/U9927AJG71 | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.276.628I | enrich_references.pubchem_identifier_url |
| patent | patent:DE10245222 | enrich_references.chebi_xrefs |
| patent | patent:EA013226 | enrich_references.chebi_xrefs |
| patent | patent:NZ541924 | enrich_references.chebi_xrefs |
| patent | patent:NZ570537 | enrich_references.chebi_xrefs |
| pesticides | pesticides:tritosulfuron | enrich_references.chebi_xrefs |
| ppdb | ppdb:674 | enrich_references.chebi_xrefs |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/11657899 | enrich_references.pubchem_compound |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/17311398 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/30594116 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/37076082 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/37564191 | enrich_references.chebi_xrefs |
| reaxys | reaxys:11343519 | enrich_references.chebi_xrefs |
| Wikidata | https://www.wikidata.org/wiki/Q4971946 | enrich_references.pubchem_identifier_url |
Elementary flows
14| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| cbe4c742-f13e-4a21-ba7f-f31024025050 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| 506e0cda-9b71-4fb8-b620-fbb4c8c2e763 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| 619ec76f-f289-4dd1-ad8b-5753c522d85c | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| fe43dbb3-a4a4-431e-baa9-e17316b05713 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 2a1348f6-427b-4eb0-b80d-0d5b57c28969 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| 3410524c-00a1-4d2d-b884-330b11942a74 | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| ac813ce8-608c-44ed-b650-2a770f0634d8 | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| c4f09665-1cd1-405b-93db-4b0328af31b6 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| 3321da4ee99ae1e496cd43b89da416e13f6c0729 | Environmental → Ground → Silvicultural | ecoinvent algorithm addition | kg | 0 |
| 481444ee-294a-4fd0-9fe3-b0aeddddd86f | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| 79d6e807-311b-494d-8378-a610598c4272 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 0e75afb6-36d0-4183-8117-36750cd512ce | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| 5ebb35f6-4d1c-48a8-8c62-5030ba9f3d07 | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| 17f034d5-85d6-43f1-8cde-f93dbf8e3697 | Environmental → Water → Unknown | EF 3.1 | kg | 4 |
History
Everything that changed this substance (59 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