Basic information
- CAS
37565-85-8- Standard SMILES
COP(=S)(OC)C(C(=O)O)c1ccccc1- InChIKey
OYGXJBSFHHOHQS-UHFFFAOYSA-N- Molecular formula
- C10H13O4PS
- Average molar mass
- 260.25 g/mol
- Monoisotopic mass
- 260.02721706
Names & identifiers
- Preferred name
- (Dimethoxyphosphorothioyl)(phenyl)acetic acid
- IUPAC
- 2-dimethoxyphosphinothioyl-2-phenylacetic acid
Names & synonyms
(dimethoxyphosphorothioyl)(phenyl)acetic acid37565-85-8DTXSID60958634RefChem:1050852DTXCID301386535alpha-(Dimethoxyphosphinothioyl)benzeneacetic acidBenzeneacetic acid, alpha-(dimethoxyphosphinothioyl)-
Database identifiers
- CAS
37565-85-8- PubChem CID
- 216656
- DTXSID
DTXSID60958634
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 87.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 281
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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