Chlormequat
fo-dd48e1212f4eeb1e
Identity
- Type
- Molecular cation
- CAS
- 7003-89-6
- EC
- —
- Origin
- ecoinvent-3.12 hybrid_name_cas_v1
- Changes
- 0 across every transformer
Structure
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 |
|---|---|---|
| plant growth regulator CHEBI:26155 | A chemical, natural or artificial, that can affect the rate of growth of a plant. | ChEBI |
Alternative labels
6- (2-chloroethyl)trimethylammonium
- (beta-chloroethyl)trimethylammonium
- 2-chloro-N,N,N-trimethylethan-1-aminium
- 2-chloro-N,N,N-trimethylethanaminium
- trimethyl-(2-chloroethyl)-ammonium
- trimethyl-(beta-chloroethyl)-ammonium
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 1 |
| InChI2D key string chemrof:inchi2d_key_string | JUZXDNPBRPUIOR-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C5H13ClN/c1-7(2,3)5-4-6/h4-5H2,1-3H3/q+1 |
| IUPAC name chemrof:IUPAC_name | (2-chloroethyl)trimethylammonium |
| Molecular formula chemrof:molecular_formula | C5H13ClN, C5H13ClN+ |
| Molecular mass chemrof:molecular_mass | 122.619 |
| Monoisotopic mass chemrof:monoisotopic_mass | 122.0731, 122.073104 |
| SMILES string chemrof:smiles_string | C[N+](C)(C)CCCl |
Known URLs
12Where 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=7003-89-6 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:81850 | enrich_references.chebi_id_link |
| KEGG | https://www.genome.jp/entry/C18585 | enrich_references.chebi_xrefs |
| pesticides | pesticides:chlormequat | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/16466532 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/21497564 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/22686367 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/26536804 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/27020619 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/27423755 | enrich_references.chebi_xrefs |
| reaxys | reaxys:1736831 | enrich_references.chebi_xrefs |
| Wikipedia | https://en.wikipedia.org/wiki/chlormequat | enrich_references.chebi_xrefs |
Elementary flows
7| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 8fe5820cac4f8affe4a3e5e43c5c00c5c9242753 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | ecoinvent algorithm addition | kg | 0 |
| 8c99473ce26ea56ead40c7493cda23ca7ff8b1c1 | Environmental → Air → Unknown | ecoinvent algorithm addition | kg | 0 |
| 14ffaed3d306d2e248bd3abe8f7bc5ed1fcfefc7 | Environmental → Ground → Agricultural | ecoinvent algorithm addition | kg | 0 |
| 992d75c34aa9bc9e275c394a9be927ce6eaca0a7 | Environmental → Ground → Silvicultural | ecoinvent algorithm addition | kg | 0 |
| 07275546fdafa739777e72d7c3ff0251a9418a80 | Environmental → Ground → Unknown | ecoinvent algorithm addition | kg | 0 |
| c55d0c6700e7ff542af8e8f5a7fee9c0de92b5b3 | Environmental → Water → Surface water | ecoinvent algorithm addition | kg | 0 |
| 9fe0a3d42a418c54f9a7d3d48fa957b7ef0f8c79 | Environmental → Water → Unknown | ecoinvent algorithm addition | kg | 0 |
History
Everything that changed this substance (0 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