Spirodiclofen
fo-883b66d701fbb925
Identity
- Type
- Neutral molecule
- CAS
- 148477-71-8
- EC
- 604-636-5
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 58 across every transformer
Structure
What it is used for
2
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 |
|---|---|---|
| acaricide CHEBI:22153 | A substance used to destroy pests of the subclass Acari (mites and ticks). | 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
4- 1-Oxaspiro[4.5]decane, butanoic acid deriv.
- 3-(2,4-dichlorophenyl)-2-oxo-1-oxaspiro[4.5]dec-3-en-4-yl 2,2-dimethylbutanoate
- Butanoic acid, 2,2-dimethyl-, 3-(2,4-dichlorophenyl)-2-oxo-1-oxaspiro[4.5]dec-3-en-4-yl ester
- Envidor
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | DTDSAWVUFPGDMX-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C21H24Cl2O4/c1-4-20(2,3)19(25)26-17-16(14-9-8-13(22)12-15(14)23)18(24)27-21(17)10-6-5-7-11-21/h8-9,12H,4-7,10-11H2,1-3H3 |
| IUPAC name chemrof:IUPAC_name | 3-(2,4-dichlorophenyl)-2-oxo-1-oxaspiro[4.5]dec-3-en-4-yl 2,2-dimethylbutanoate |
| Molecular formula chemrof:molecular_formula | C21H24Cl2O4 |
| Molecular mass chemrof:molecular_mass | 411.325 |
| Monoisotopic mass chemrof:monoisotopic_mass | 410.10516, 410.105165 |
| SMILES string chemrof:smiles_string | CCC(C)(C)C(=O)OC1=C(c2ccc(Cl)cc2Cl)C(=O)OC12CCCCC2 |
Known URLs
15Where 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 |
|---|---|---|
| beilstein | beilstein:9660994 | enrich_references.chebi_xrefs |
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=148477-71-8 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:38639 | enrich_references.chebi_id_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.130.204 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID6034928 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL2227839 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/3X7G31F5MX | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.571.716E | enrich_references.pubchem_identifier_url |
| KEGG | https://www.genome.jp/entry/C18553 | enrich_references.chebi_xrefs |
| kegg.jp | https://www.kegg.jp/entry/C18553 | enrich_references.pubchem_identifier_url |
| metabolomicsworkbench.org | https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=55947 | enrich_references.pubchem_identifier_url |
| ppdb | ppdb:597 | enrich_references.chebi_xrefs |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/177863 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q425807 | enrich_references.pubchem_identifier_url |
| Wikipedia | https://en.wikipedia.org/wiki/Spirodiclofen | enrich_references.pubchem_identifier_url |
Elementary flows
14| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 2c258424-dbac-4055-a230-a62639044a2b | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| bdc38ce9-318a-4e88-834d-e544a713a203 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| 0dcf4253-a06b-4923-a843-d062be5d2100 | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| d45a2623-36f6-41a2-9a53-ab719512b98a | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 567d34de-55f4-4bd0-a101-e25127315448 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| 36c13fed-f566-46e8-bbb8-21c8a1910fdb | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| 06f73ad6-2034-4bd1-85a3-b5f32f48f86a | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| 19b460a4-6314-4d3b-8453-82edf43bbb08 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| de9fc31f7ea1cfceec389230504fa52fb07adfea | Environmental → Ground → Silvicultural | ecoinvent algorithm addition | kg | 0 |
| 9fd50c75-ac41-47e3-b67c-b29e191a7eee | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| 99a8f669-4b59-46d5-9d83-b83948a85325 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 86b538f2-a2dd-4396-b996-4f79fdefe1fc | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| 8eada03c-f673-4853-9fda-22239717cddf | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| 5961b877-b75b-4e75-bd9a-f67f38b8d839 | 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