Terbumeton
fo-7d9c6fbd52100859
Identity
- Type
- Neutral molecule
- CAS
- 33693-04-8
- EC
- 251-637-8
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 57 across every transformer
Structure
What it is used for
4
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 |
| 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
18- 1,3,5-Triazine-2,4-diamine, N-(1,1-dimethylethyl)-N′-ethyl-6-methoxy-
- 1,3,5-Triazine-2,4-diamine, N2-(1,1-dimethylethyl)-N4-ethyl-6-methoxy-
- 2-(tert-butylamino)-4-(ethylamino)-6-methoxy-s--triazine
- 2-Methoxy-4-ethylamino-6-tert-butylamino-s-triazine
- 2-N-tert-Butyl-4-N-ethyl-6-methoxy-1,3,5-triazine-2,4-diamine
- 4-(Ethylamino)-2-methoxy-6-(tert-butylamino)-s-triazine
- Caragard
- Karagard
- MEBT
- N(2)-tert-butyl-N(4)-ethyl-6-methoxy-1,3,5-triazine-2,4-diamine
- N-(1,1-dimethylethyl)-N'-ethyl-6-methoxy-1,3,5-triazine-2,4-diamine
- N-tert-butyl-N'-ethyl-6-methoxy-1,3,5-triazine-2,4-diamine
- N2-(1,1-Dimethylethyl)-N4-ethyl-6-methoxy-1,3,5-triazine-2,4-diamine
- s-Triazine, 2-(tert-butylamino)-4-(ethylamino)-6-methoxy-
- terbuthylon
- Terbutone
- tert-Bumeton
- Tribunil G 14259
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | BCQMBFHBDZVHKU-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C10H19N5O/c1-6-11-7-12-8(15-10(2,3)4)14-9(13-7)16-5/h6H2,1-5H3,(H2,11,12,13,14,15) |
| IUPAC name chemrof:IUPAC_name | N(2)-tert-butyl-N(4)-ethyl-6-methoxy-1,3,5-triazine-2,4-diamine |
| Molecular formula chemrof:molecular_formula | C10H19N5O |
| Molecular mass chemrof:molecular_mass | 225.296 |
| Monoisotopic mass chemrof:monoisotopic_mass | 225.15896 |
| SMILES string chemrof:smiles_string | CCNc1nc(NC(C)(C)C)nc(OC)n1 |
Known URLs
18Where 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=33693-04-8 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:81947 | enrich_references.chebi_id_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.046.929 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID1042445 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3560827 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/8Q68893703 | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J4.385K | enrich_references.pubchem_identifier_url |
| KEGG | https://www.genome.jp/entry/C18768 | enrich_references.chebi_xrefs |
| kegg.jp | https://www.kegg.jp/entry/C18768 | enrich_references.pubchem_identifier_url |
| patent | patent:EA003143 | enrich_references.chebi_xrefs |
| pesticides | pesticides:terbumeton | enrich_references.chebi_xrefs |
| ppdb | ppdb:622 | enrich_references.chebi_xrefs |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/36584 | enrich_references.pubchem_compound |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/16674993 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/24607694 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/25365583 | enrich_references.chebi_xrefs |
| reaxys | reaxys:520400 | enrich_references.chebi_xrefs |
| Wikidata | https://www.wikidata.org/wiki/Q1650548 | enrich_references.pubchem_identifier_url |
Elementary flows
14| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 9ded3e1a-5053-4f4e-b173-bdbf9ea8e2d1 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| f19e06a4-c8cf-4033-a7f6-0beec9a40ba9 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| c385aac9-3366-42b8-a5a7-2b9a0ea114ab | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| 9bff7637-6c6b-4752-a9a5-b399788adb2d | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 35ac307c-2aac-4898-9132-b496af3695f5 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| c6caa913-8cd4-4353-ba26-cda51e1f07bd | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| 6e0a097e-ff9f-4099-9b27-f9be87a37bc0 | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| 48b6f149-e5f8-46c8-80c8-95b9c85cb244 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| fd0da123aadf3df1b2c3d71e9139c7519e93a8ff | Environmental → Ground → Silvicultural | ecoinvent algorithm addition | kg | 0 |
| 3876ce91-e54f-449e-85c0-956693e4bb21 | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| 5f778204-5ba0-4a03-b448-722471905525 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 6f4fe96b-db90-4f1c-a5e6-7f14674c3e5b | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| 2696bb28-7570-48cc-9a64-c0e80b375be5 | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| 20ac99b8-fa51-4cc1-9efd-849ff806c67c | Environmental → Water → Unknown | EF 3.1 | kg | 2 |
History
Everything that changed this substance (57 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