Basic information
- CAS
3772-46-1- Standard SMILES
CCOP(=S)(OCC)SCCSC- InChIKey
ZJIYXRGCBVAJKD-UHFFFAOYSA-N- Molecular formula
- C7H17O2PS3
- Average molar mass
- 260.4 g/mol
- Monoisotopic mass
- 260.0128303
Names & identifiers
- Preferred name
- Phosphorodithioic acid, O,O-diethyl S-(2-(methylthio)ethyl) ester
- IUPAC
- diethoxy-(2-methylsulfanylethylsulfanyl)-sulfanylidene-λ5-phosphane
Names & synonyms
3772-46-1Phosphorodithioic acid, O,O-diethyl S-(2-(methylthio)ethyl) esterDTXSID50191154RefChem:1095444DTXCID60113645M 80BRN 1708507O,O-diethyl S-(methylthio-ethyl) phosphorodithioateO,O-diethyl S-[2-(methylsulfanyl)ethyl] phosphorodithioate
Database identifiers
- CAS
3772-46-1- PubChem CID
- 199149
- DTXSID
DTXSID50191154
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 156
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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