Dichloroisothiocyanatophosphine
Basic information
- CAS
1858-38-4- Standard SMILES
O=P(Cl)(Cl)N=C=S- InChIKey
FKIOCEDPFOZQLW-UHFFFAOYSA-N- Molecular formula
- CCl2NOPS
- Average molar mass
- 175.96 g/mol
- Monoisotopic mass
- 174.8815272
Names & identifiers
- Preferred name
- Dichloroisothiocyanatophosphine
- IUPAC
- dichlorophosphorylimino(sulfanylidene)methane
- English name
- dichloroisothiocyanatophosphine
- Molecular formula
- CCl2NOPS
- Molecular weight
- 175.96
Names & synonyms
Dichloroisothiocyanatophosphine1858-38-4dichlorophosphorylimino(sulfanylidene)methanephosphorisothiocyanatidic dichlorideEINECS 217-457-9DTXSID50171799FKIOCEDPFOZQLW-UHFFFAOYSA-NIsothiocyanatodichlorophosphine oxidePhosphine oxide, dichloroisothiocyanato-
Database identifiers
- CAS
1858-38-4- PubChem CID
- 74620
- DTXSID
DTXSID50171799- EC Number
- 217-457-9
- Nikkaji
- J199.672J
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 61.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 146
Physicochemical properties
- Boiling point
- 204.2 · 204.2±23.0 °C(Predicted)
- Density
- 1.79 · 1.79±0.1 g/cm3(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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