Basic information
- CAS
657-40-9- Standard SMILES
FP(F)(=S)c1ccccc1- InChIKey
HNIMECYZAFNCNB-UHFFFAOYSA-N- Molecular formula
- C6H5F2PS
- Average molar mass
- 178.14 g/mol
- Monoisotopic mass
- 177.98176465
Names & identifiers
- Preferred name
- Phosphonothioic difluoride, phenyl-
- IUPAC
- difluoro-phenyl-sulfanylidene-λ5-phosphane
- English name
- Phenyldifluorophosphine sulfide
- Molecular formula
- C6H5F2PS
- Molecular weight
- 178.14
Names & synonyms
Phosphonothioic difluoride, phenyl-657-40-9DTXSID60341461RefChem:173647DTXCID80292542HNIMECYZAFNCNB-UHFFFAOYSA-NPhenylphosphonothioic difluoridePhenylphosphonothioic difluoride #Phenyldifluorophosphine sulfidePhosphonothioic difluoride, P-phenyl-
Database identifiers
- CAS
657-40-9- PubChem CID
- 573259
- DTXSID
DTXSID60341461- Nikkaji
- J130.426G
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 32.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 148
Experimental & physicochemical properties
SpringerMaterials Properties31P nuclear magnetic resonance spectrum
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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