Basic information
- CAS
38052-05-0- Standard SMILES
CCOP(=S)(Cl)Oc1ccccc1- InChIKey
NUESSQYZNOVTAQ-UHFFFAOYSA-N- Molecular formula
- C8H10ClO2PS
- Average molar mass
- 236.66 g/mol
- Monoisotopic mass
- 235.9827654
Overview
RN given refers to cpd without isomeric designation
Names & identifiers
- Preferred name
- Phosphorochloridothioic acid, O-ethyl O-phenyl ester
- IUPAC
- chloro-ethoxy-phenoxy-sulfanylidene-λ5-phosphane
- English name
- O-ethyl-O-phenylchlorothiophosphate
- Molecular formula
- C8H10ClO2PS
- Molecular weight
- 236.66
Names & synonyms
O-Ethyl-O-phenylchlorothiophosphate38052-05-0Phosphorochloridothioic acid, O-ethyl O-phenyl esterEPCTPRefChem:167204BRN 2213924chloro-ethoxy-phenoxy-sulfanylidene-lambda5-phosphane4-06-00-00756 (Beilstein Handbook Reference)SCHEMBL11273577DTXSID90959013O-Ethyl O-phenyl phosphorochloridothioateO-Phenyl-O-ethylchlorothiophosphate
Database identifiers
- CAS
38052-05-0- PubChem CID
- 148232
- DTXSID
DTXSID90959013- Nikkaji
- J2.562.926D
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 50.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 195
Physicochemical properties
- Boiling point
- 95 · 95-100 °C(Press: 0.2 Torr)
- Density
- 1.2666 g/cm3 · 1.2666 g/cm3
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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