Basic information
- CAS
2279-84-7- Standard SMILES
CCOP(=S)(OCC)SCC(=O)N(C)C- InChIKey
LGFKFEXFCYPXQC-UHFFFAOYSA-N- Molecular formula
- C8H18NO3PS2
- Average molar mass
- 271.3 g/mol
- Monoisotopic mass
- 271.04657278
Names & identifiers
- Preferred name
- Phosphorodithioic acid, O,O-diethyl S-(2-(dimethylamino)-2-oxoethyl) ester
- IUPAC
- 2-diethoxyphosphinothioylsulfanyl-N,N-dimethylacetamide
Names & synonyms
BRN 1793590Phosphorodithioic acid, O,O-diethyl S-(2-(dimethylamino)-2-oxoethyl) ester2279-84-7O,O-Diethyl S-(N,N-dimethylcarbamoylmethyl) phosphorodithioateDTXSID601773284-04-00-00254 (Beilstein Handbook Reference)RefChem:371126DTXCID0099819S-[2-(Dimethylamino)-2-oxoethyl] O,O-diethyl phosphorodithioate
Database identifiers
- CAS
2279-84-7- PubChem CID
- 200587
- DTXSID
DTXSID60177328
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 96.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 238
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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