Etaconazole
fo-20ce50aa34135957
Identity
- Type
- Neutral molecule
- CAS
- 60207-93-4
- EC
- 262-107-0
- Origin
- ecoinvent-3.12 hybrid_name_cas_v1
- Changes
- 0 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
1- 1-((2-(2,4-Dichlorophenyl)-4-ethyl-1,3-dioxolan-2-yl)methyl)-1H-1,2,4-triazole
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | DWRKFAJEBUWTQM-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C14H15Cl2N3O2/c1-2-11-6-20-14(21-11,7-19-9-17-8-18-19)12-4-3-10(15)5-13(12)16/h3-5,8-9,11H,2,6-7H2,1H3 |
| IUPAC name chemrof:IUPAC_name | 1-((2-(2,4-Dichlorophenyl)-4-ethyl-1,3-dioxolan-2-yl)methyl)-1H-1,2,4-triazole |
| Molecular formula chemrof:molecular_formula | C14H15Cl2N3O2 |
| Molecular mass chemrof:molecular_mass | 328.199 |
| Monoisotopic mass chemrof:monoisotopic_mass | 327.05413, 327.054132 |
| SMILES string chemrof:smiles_string | CCC1COC(Cn2cncn2)(c2ccc(Cl)cc2Cl)O1 |
Known URLs
6Where 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=60207-93-4 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:4874 | enrich_references.chebi_id_link |
| KEGG | https://www.genome.jp/entry/C11293 | enrich_references.chebi_xrefs |
| patent | patent:NZ587951 | enrich_references.chebi_xrefs |
| ppdb | ppdb:1196 | enrich_references.chebi_xrefs |
| reaxys | reaxys:834090 | enrich_references.chebi_xrefs |
Elementary flows
7| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 1bc022cb8f70cfda0384cd3f2f4ca3e723efca7d | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | ecoinvent algorithm addition | kg | 0 |
| 192c33173da2cb3251895c943dd1875d78f77700 | Environmental → Air → Unknown | ecoinvent algorithm addition | kg | 0 |
| 570263ca5158b242c2f11d44049db6285952e8d9 | Environmental → Ground → Agricultural | ecoinvent algorithm addition | kg | 0 |
| ec11883cbd86f2f8ec42417228324554d8e6c81d | Environmental → Ground → Silvicultural | ecoinvent algorithm addition | kg | 0 |
| d5f48204ccd3048d5700bed822158b395f0ecaf8 | Environmental → Ground → Unknown | ecoinvent algorithm addition | kg | 0 |
| e9e95677dff8dfdbccd1a5cd0d3ccc0ee4f08d02 | Environmental → Water → Surface water | ecoinvent algorithm addition | kg | 0 |
| 7f0b0c5001284a0501b623ce0deccc73a7a2cb67 | 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