Dichlofenthion
fo-3f5892d1a3ac8a34
Identity
- Type
- Neutral molecule
- CAS
- 97-17-6
- EC
- 202-564-5
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 56 across every transformer
Structure
Alternative labels
8- ECP (pesticide)
- Hexanema
- Nemacide
- O,O-Diethyl O-(2,4-dichlorophenyl) phosphorothioate
- O-(2,4-Dichlorophenyl) O,O-diethyl phosphorothioate
- Phosphorothioic acid, O-(2,4-dichlorophenyl) O,O-diethyl ester
- VC 1-13
- VC 13 Nemacide
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | WGOWCPGHOCIHBW-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C10H13Cl2O3PS/c1-3-13-16(17,14-4-2)15-10-6-5-8(11)7-9(10)12/h5-7H,3-4H2,1-2H3 |
| IUPAC name chemrof:IUPAC_name | O,O-Diethyl O-(2,4-dichlorophenyl) phosphorothioate |
| Molecular formula chemrof:molecular_formula | C10H13Cl2O3PS |
| Molecular mass chemrof:molecular_mass | 315.158 |
| Monoisotopic mass chemrof:monoisotopic_mass | 313.970007, 313.97001 |
| SMILES string chemrof:smiles_string | CCOP(=S)(OCC)Oc1ccc(Cl)cc1Cl |
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 |
|---|---|---|
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=97-17-6 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:81730 | enrich_references.chebi_id_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.002.332 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID8040274 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=52964 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1396626 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/64234GT8TT | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.976D | enrich_references.pubchem_identifier_url |
| KEGG | https://www.genome.jp/entry/C18398 | enrich_references.chebi_xrefs |
| kegg.jp | https://www.kegg.jp/entry/C18398 | enrich_references.pubchem_identifier_url |
| ncithesaurus.nci.nih.gov | https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C83669 | enrich_references.pubchem_identifier_url |
| ppdb | ppdb:215 | enrich_references.chebi_xrefs |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/7328 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q3026533 | enrich_references.pubchem_identifier_url |
| Wikipedia | https://en.wikipedia.org/wiki/Dichlofenthion | enrich_references.pubchem_identifier_url |
Elementary flows
14| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| d38cf29a-c4d8-4173-9f68-7f8abdac3d32 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| f9459227-1aeb-49a0-a04e-72ea4df53562 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| aaf71c4c-369b-49c4-8fa5-6e246d36e0ce | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| 70e03b56-e4b0-4b4d-8ece-29a28b1d87fa | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 998ce9a8-dc0c-4a0a-8dfd-773193f661ca | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| 7fad4842-1e18-43f4-8f78-825e6f1a4199 | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| 8bef7b82-758c-4016-8b40-20baffd4edff | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| 0ebed0ec-31a1-4b42-a712-1d43f753824a | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| c466c07f57bd906b65a0519e1f8f748a31c60d16 | Environmental → Ground → Silvicultural | ecoinvent algorithm addition | kg | 0 |
| e6d58f22-58b5-41cf-9502-aaf3182f895f | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| 489a8a69-0bf2-40fe-9159-e8cd0f501e39 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| cd44b7f8-6c8b-41c4-a8b6-31279c38c0ff | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| dde74c43-23dc-412d-9f40-88418d612db5 | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| 98a8d78a-8a6f-426b-86cf-6b8a3fc4ce64 | Environmental → Water → Unknown | EF 3.1 | kg | 2 |
History
Everything that changed this substance (56 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