Basic information
- CAS
3694-54-0- Standard SMILES
CCOP(=S)(Nc1ccccc1)OCC- InChIKey
VTOGWEUSGRPLPD-UHFFFAOYSA-N- Molecular formula
- C10H16NO2PS
- Average molar mass
- 245.28 g/mol
- Monoisotopic mass
- 245.06393692
Names & identifiers
- Preferred name
- O,O-Diethyl N-phenylphosphoramidothioate
- IUPAC
- N-diethoxyphosphinothioylaniline
Names & synonyms
Phosphoramidothioic acid, phenyl-, O,O-diethyl ester3694-54-0DTXSID20190437O,O-Diethyl N-phenylphosphoramidothioateRefChem:1093491DTXCID30112928Diethyl anilidothiophosphatePhenylphosphoramidothioic acid O,O-diethyl esterBRN 28077294-12-00-01090 (Beilstein Handbook Reference)
Database identifiers
- CAS
3694-54-0- PubChem CID
- 199100
- DTXSID
DTXSID20190437
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 62.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 209
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…