Basic information
- CAS
76659-92-2- Standard SMILES
COP(=O)(Oc1cc(Cl)ccc1Cl)c1ccccc1- InChIKey
CTFGBIJKVBZCHE-UHFFFAOYSA-N- Molecular formula
- C13H11Cl2O3P
- Average molar mass
- 317.1 g/mol
- Monoisotopic mass
- 315.9822866
Names & identifiers
- Preferred name
- 2,5-Dichlorophenyl methyl phenylphosphonate
- IUPAC
- 1,4-dichloro-2-[methoxy(phenyl)phosphoryl]oxybenzene
Names & synonyms
DTXSID309140452,5-Dichlorophenyl methyl phenylphosphonateRefChem:1060079DTXCID201343041BRN 287200497232-58-1(S)-Phenylphosphonic acid 2,5-dichlorophenyl methyl ester(R)-Phenylphosphonic acid 2,5-dichlorophenyl methyl ester(+-)-Phenylphosphonic acid 2,5-dichlorophenyl methyl esterPhosphonic acid, phenyl-, 2,5-dichlorophenyl methyl ester, (+-)-Phosphonic acid, phenyl-, 2,5-dichlorophenyl methyl ester, (R)-Phosphonic acid, phenyl-, 2,5-dichlorophenyl methyl ester, (S)-
Show more names
76659-92-297151-13-8Phosphonic acid, phenyl-, 2,5-dichlorophenyl methyl ester97232-57-0
Database identifiers
- CAS
76659-92-2、97151-13-8、97232-57-0、97232-58-1- PubChem CID
- 175695
- DTXSID
DTXSID30914045
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 334
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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