3-[(Dibutoxyphosphinothioyl)thio]propionic acid methyl ester
Basic information
- CAS
53214-11-2- Standard SMILES
CCCCOP(=S)(OCCCC)SCCC(=O)OC- InChIKey
OGDMOVUFZWAHBP-UHFFFAOYSA-N- Molecular formula
- C12H25O4PS2
- Average molar mass
- 328.4 g/mol
Names & identifiers
- Preferred name
- 3-[(Dibutoxyphosphinothioyl)thio]propionic acid methyl ester
- IUPAC
- methyl 3-dibutoxyphosphinothioylsulfanylpropanoate
- English name
- 3-[(Dibutoxyphosphinothioyl)thio]propionic acid methyl ester
- Molecular formula
- C12H25O4PS2
- Molecular weight
- 328.43
Names & synonyms
SCHEMBL33424683-[(Dibutoxyphosphinothioyl)thio]propionic acid methyl esterDB-29400353214-11-2Propanoic acid, 3-[(dibutoxyphosphinothioyl)thio]-, methyl ester
Database identifiers
- CAS
53214-11-2- Nikkaji
- J195.825I
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 13
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 273
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…