Phosphorothioate
Basic information
- CAS
15181-41-6- Standard SMILES
[O-]P([O-])([O-])=S- InChIKey
RYYWUUFWQRZTIU-UHFFFAOYSA-K- Molecular formula
- O3PS-3
- Average molar mass
- 111.04 g/mol
- Monoisotopic mass
- 110.93057703
Names & identifiers
- Preferred name
- Phosphorothioate
- IUPAC
- thiophosphate
- English name
- PHOSPHOROTHIOATE
- Molecular weight
- 0
Names & synonyms
PhosphorothioateThiophosphate ionPhosphorothiolate ionPhosphorothionate ion15181-41-6DTXSID30164881RefChem:173880DTXCID9087372Phospho- rothioatRYYWUUFWQRZTIU-UHFFFAOYSA-K
Database identifiers
- CAS
15181-41-6- PubChem CID
- 167253
- DTXSID
DTXSID30164881
Properties
Computed structural properties
- XLogP
- -0.6
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 5
- Formal charge
- -3
- Complexity
- 53
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Related reactions
9 records
Compound notes
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