Phosphinecarboxylic acid, hydroxy(4-methoxyphenoxy)-, oxide

HCID 512082

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Basic information

CAS: 74270-25-0
Standard SMILES: COc1ccc(OP(=O)(O)C(=O)O)cc1
InChIKey: MNLGQNVSBMBKQH-UHFFFAOYSA-N
Molecular formula: C8H9O6P
Average molar mass: 232.13 g/mol
Monoisotopic mass: 232.013675

Names & identifiers

Preferred name: Phosphinecarboxylic acid, hydroxy(4-methoxyphenoxy)-, oxide
IUPAC: [hydroxy-(4-methoxyphenoxy)phosphoryl]formic acid

Names & synonyms

Phosphinecarboxylic acid, hydroxy(4-methoxyphenoxy)-, oxide74270-25-0[hydroxy-(4-methoxyphenoxy)phosphoryl]formic acidCHEMBL1205373DTXSID20225278Hydroxy(4-methoxyphenoxy)(oxo)-lambda~5~-phosphanecarboxylic acid

Database identifiers

CAS: 74270-25-0
PubChem CID: 512082
DTXSID: DTXSID20225278
ChEMBL: CHEMBL1205373

Properties

Computed structural properties

XLogP: 0.6
Topological polar surface area: 93.1 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 6
Rotatable bonds: 4
Heavy atoms: 15
Formal charge: 0
Complexity: 270

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