Basic information
- CAS
5827-03-2- Standard SMILES
CCN(CC)C(=S)SP(=S)(OC(C)C)OC(C)C- InChIKey
BAFCBDVCYCRYPM-UHFFFAOYSA-N- Molecular formula
- C11H24NO2PS3
- Average molar mass
- 329.5 g/mol
- Monoisotopic mass
- 329.07067953
Names & identifiers
- Preferred name
- Ent 24725
- IUPAC
- di(propan-2-yloxy)phosphinothioyl N,N-diethylcarbamodithioate
Names & synonyms
Holcomb compound 326ENT 247255827-03-2ENT 24,725N,N-Diethylthiocarbamyl O,O-diisopropyldithiophosphateAI3-24725DTXSID70206996S-Diethylthiocarbamoyl O,O-diisopropyl phosphorothioateDiisopropyl ester of dithiocarbamyl phosphorothioic acidO,O-Diisopropyl-S-diethyldithiocarbamoylphosphorodithioateDiethyldithiocarbamic anhydride of O,O-diisopropyl thionophosphoric acidDiethyldithiocarbamic phosphorodithioic anhydrosulfide, O,O-diisopropyl ester
Show more names
Carbamic acid, diethyldithio-, anhydrosulfide with O,O-diisopropylphosphorodithioateO,O-Diiospropyl dithiophosphoric acid ester of N,N-diethyldithiocarbamic anhydrosulfideCarbamodithioic acid, diethyl-, anhydrosulfide with O,O-bis(1-methylethyl) hydrogen phosphorodithioateRefChem:339591DTXCID00129487
Database identifiers
- CAS
5827-03-2- PubChem CID
- 22080
- DTXSID
DTXSID70206996
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 111 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 293
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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