Phosphonothioic acid, methyl-, O-(2,5-dichlorophenyl) O-methyl ester
Basic information
- CAS
112905-14-3- Standard SMILES
COP(C)(=S)Oc1cc(Cl)ccc1Cl- InChIKey
HYFPNIMNMQUPNE-UHFFFAOYSA-N- Molecular formula
- C8H9Cl2O2PS
- Average molar mass
- 271.1 g/mol
- Monoisotopic mass
- 269.9437931
Names & identifiers
- Preferred name
- Phosphonothioic acid, methyl-, O-(2,5-dichlorophenyl) O-methyl ester
- IUPAC
- (2,5-dichlorophenoxy)-methoxy-methyl-sulfanylidene-λ5-phosphane
Names & synonyms
112905-14-3o-(2,5-dichlorophenyl) o-methyl methylphosphonothioatePhosphonothioic acid, methyl-, O-(2,5-dichlorophenyl) O-methyl esterDTXSID70920948
Database identifiers
- CAS
112905-14-3- PubChem CID
- 188701
- DTXSID
DTXSID70920948
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 50.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 239
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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