Basic information
- CAS
19594-35-5- Standard SMILES
CCOP(=S)(OCC)SC(COC(=O)CC)COC(=O)CC- InChIKey
RJDHZNOONXZYKJ-UHFFFAOYSA-N- Molecular formula
- C13H25O6PS2
- Average molar mass
- 372.4 g/mol
- Monoisotopic mass
- 372.08301786
Names & identifiers
- Preferred name
- Phosphorodithioic acid, O,O-diethyl S-(2-(1,3-dicarbethoxy)propyl) ester
- IUPAC
- (2-diethoxyphosphinothioylsulfanyl-3-propanoyloxypropyl) propanoate
- English name
- Phosphorodithioic acid O,O-diethyl S-[1-(ethoxycarbonylmethyl)-2-(ethoxycarbonyl)ethyl] ester
- Molecular formula
- C13H25O6PS2
- Molecular weight
- 372.44
Names & synonyms
beta-Glutarate malathion19594-35-5O,O-Diethyl(S-2(1,3-dicarbethoxy)propyl) phosphorodithioatePhosphorodithioic acid, O,O-diethyl S-(2-(1,3-dicarbethoxy)propyl) esterRefChem:371124(2-diethoxyphosphinothioylsulfanyl-3-propanoyloxypropyl) propanoate2-[(diethoxyphosphorothioyl)sulfanyl]propane-1,3-diyl dipropanoateDTXSID20941365Phosphorodithioic acid O,O-diethyl S-[1-(ethoxycarbonylmethyl)-2-(ethoxycarbonyl)ethyl] esterβ-Glutarate malathionPentanedioic acid, 3-[(diethoxyphosphinothioyl)thio]-, 1,5-diethyl ester
Database identifiers
- CAS
19594-35-5- PubChem CID
- 88161
- DTXSID
DTXSID20941365
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 128 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 14
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 361
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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