Basic information
- CAS
5431-19-6- Standard SMILES
O=P(O)(O)c1ccccc1Cl- InChIKey
AOJSHUFFESHCRA-UHFFFAOYSA-N- Molecular formula
- C6H6ClO3P
- Average molar mass
- 192.53 g/mol
- Monoisotopic mass
- 191.9743087
Names & identifiers
- Preferred name
- Phosphonic acid, (o-chlorophenyl)-
- IUPAC
- (2-chlorophenyl)phosphonic acid
Names & synonyms
(2-Chlorophenyl)phosphonic acid(o-Chlorophenyl)phosphonic acidPhosphonic acid, (o-chlorophenyl)-Phosphonic acid, (2-chlorophenyl)-5431-19-6NSC-13561WF2MK2H74DDTXSID50202678RefChem:1095162DTXCID80125169NSC 13561BRN 3250497
Show more names
141456-83-9SCHEMBL1772612-chlorophenylphos-phonic acidSCHEMBL28140308SCHEMBL31560059AOJSHUFFESHCRA-UHFFFAOYSA-NP-(2-Chlorophenyl)phosphonic acidNSC13561
Database identifiers
- CAS
5431-19-6- PubChem CID
- 95012
- DTXSID
DTXSID50202678- UNII
- WF2MK2H74D
- Nikkaji
- J135.739E
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 57.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 179
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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