Basic information
- CAS
35944-86-6- Standard SMILES
CCOP(=O)(OCC)O/C(=C\SCC)c1ccc(Cl)cc1- InChIKey
BZMIJSJGWSNSTE-KAMYIIQDSA-N- Molecular formula
- C14H20ClO4PS
- Average molar mass
- 350.8 g/mol
- Monoisotopic mass
- 350.050845
Names & identifiers
- Preferred name
- GC 4276
- IUPAC
- [(Z)-1-(4-chlorophenyl)-2-ethylsulfanylethenyl] diethyl phosphate
Names & synonyms
GC 427635944-86-6RefChem:1085733Phosphoric acid, 1-(4-chlorophenyl)-2-(ethylthio)ethenyl diethyl esterPhosphoric acid, diethyl (2-ethylthio-1-p-chlorophenyl)vinyl ester
Database identifiers
- CAS
35944-86-6- PubChem CID
- 6438121
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 70.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 360
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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