Basic information
- CAS
3070-19-7- Standard SMILES
CCOP(=S)(OCC)Oc1ccc([N+](=O)[O-])c(Cl)c1- InChIKey
BDLIWEUZZIHMSW-UHFFFAOYSA-N- Molecular formula
- C10H13ClNO5PS
- Average molar mass
- 325.71 g/mol
- Monoisotopic mass
- 324.9940584
Names & identifiers
- Preferred name
- Ethyl chlorthion
- IUPAC
- (3-chloro-4-nitrophenoxy)-diethoxy-sulfanylidene-λ5-phosphane
Names & synonyms
Ethyl chlorthionEthylchlorothionChlorthion ethylBRN 2478137O-(3-Chloro-4-nitrophenyl) O,O-diethyl phosphorothioateO,O-Diethyl O-(3-chloro-4-nitrophenyl) phosphorothioate3070-19-7DTXSID40184732Phosphorothioic acid, O-(3-chloro-4-nitrophenyl) O,O-diethyl esterRefChem:344782DTXCID80107223
Database identifiers
- CAS
3070-19-7- PubChem CID
- 200990
- DTXSID
DTXSID40184732
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 106 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 343
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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