O,O-Diethyl S-(2-(diethylamino)ethyl) phosphorodithioate
Basic information
- CAS
23713-11-3- Standard SMILES
CCOP(=S)(OCC)SCCN(CC)CC- InChIKey
MACIOZCPWKONIF-UHFFFAOYSA-N- Molecular formula
- C10H24NO2PS2
- Average molar mass
- 285.4 g/mol
- Monoisotopic mass
- 285.09860835
Names & identifiers
- Preferred name
- O,O-Diethyl S-(2-(diethylamino)ethyl) phosphorodithioate
- IUPAC
- 2-diethoxyphosphinothioylsulfanyl-N,N-diethylethanamine
Names & synonyms
NIOSH/TD7176000TD71760000O,O-Diethyl S-(2-(diethylamino)ethyl) phosphorodithioatePhosphorodithioic acid, O,O-diethyl S-(2-(diethylamino)ethyl) esterNSC133009CHEMBL223163NSC-133009
Database identifiers
- CAS
23713-11-3- PubChem CID
- 280837
- ChEMBL
CHEMBL223163- Nikkaji
- J1.926.950G
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 79.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 10
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 203
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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