Basic information
- CAS
1707-04-6- Standard SMILES
Cc1ccc(P(=O)(O)O)cc1Cl- InChIKey
NMXDAIBQNUHEHE-UHFFFAOYSA-N- Molecular formula
- C7H8ClO3P
- Average molar mass
- 206.56 g/mol
- Monoisotopic mass
- 205.9899588
Names & identifiers
- Preferred name
- (3-Chloro-4-methylphenyl)phosphonic acid
- IUPAC
- (3-chloro-4-methylphenyl)phosphonic acid
Names & synonyms
(3-chloro-4-methylphenyl)phosphonic acid1707-04-6DTXSID60299332RefChem:207603DTXCID20250469NSC129461SCHEMBL2669738NSC-129461
Database identifiers
- CAS
1707-04-6- PubChem CID
- 279166
- DTXSID
DTXSID60299332
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 57.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 203
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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