O,O-Dimethyl O-phenyl phosphorothioate
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Basic information
- CAS
33576-92-0- Standard SMILES
COP(=S)(OC)Oc1ccccc1- InChIKey
PZZAINQLAOZPRL-UHFFFAOYSA-N- Molecular formula
- C8H11O3PS
- Average molar mass
- 218.21 g/mol
- Monoisotopic mass
- 218.01665238
Names & identifiers
- Preferred name
- O,O-Dimethyl O-phenyl phosphorothioate
- IUPAC
- dimethoxy-phenoxy-sulfanylidene-λ5-phosphane
- English name
- O,O-Dimethyl O-phenyl phosphorothioate
- Molecular formula
- C8H11O3PS
- Molecular weight
- 218.21
Names & synonyms
O,O-Dimethyl O-phenyl phosphorothioate33576-92-0B7U41GTS1Jdimethoxy-phenoxy-sulfanylidene-lambda5-phosphanejiajizengxiaolinUNII-B7U41GTS1JDimethyl phenyl thiophosphatePhosphorothioic acid, O,O-dimethyl O-phenyl esterPhosphorothioic acid, O,O-dimethyl, o-phenyl esterSV-5SCHEMBL10455273DTXSID20879199
Show more names
O,O-DIMETHYL-PHENYLPHOSPHOROTHIOATE
O-phenyl esterO,O-dimethylphosphorothioic acidQ27274469PHOSPHOROTHIOIC ACID,O,O-DIMETHYL O-PHENYL ESTER
Database identifiers
- CAS
33576-92-0- PubChem CID
- 92291
- DTXSID
DTXSID20879199- UNII
- B7U41GTS1J
- Nikkaji
- J600.283H
Properties
Computed structural propertiesFilling in
- XLogP
- 3
- Topological polar surface area
- 59.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 184
Experimental & physicochemical properties
LogP2.97
Physicochemical properties
- Boiling point
- 83 · 83-84 °C(Press: 0.1 Torr)
- Density
- 1.23 g/cm3 · 1.23 g/cm3
- FDA UNII
- 7 U41GTS1J · B7U41GTS1J
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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