Phosphorodithioic acid, S-2,3-dihydro-1,4-oxathiinyl O,O-dimethyl ester
Basic information
- CAS
63716-52-9- Standard SMILES
COP(=S)(OC)SC1CSC=CO1- InChIKey
SVRGTAIJSHLTQN-UHFFFAOYSA-N- Molecular formula
- C6H11O3PS3
- Average molar mass
- 258.3 g/mol
- Monoisotopic mass
- 257.96079473
Names & identifiers
- Preferred name
- Phosphorodithioic acid, S-2,3-dihydro-1,4-oxathiinyl O,O-dimethyl ester
- IUPAC
- 2,3-dihydro-1,4-oxathiin-2-ylsulfanyl-dimethoxy-sulfanylidene-λ5-phosphane
Names & synonyms
63716-52-9Phosphorodithioic acid, S-2,3-dihydro-1,4-oxathiinyl O,O-dimethyl esterRefChem:1095455Hercules 3273ENT 24,398s-(2,3-dihydro-1,4-oxathiin-2-yl) o,o-dimethyl phosphorodithioateDTXSID00980090
Database identifiers
- CAS
63716-52-9- PubChem CID
- 113758
- DTXSID
DTXSID00980090
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 225
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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