2-Hydroxypropan-2-ylphosphonic acid

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Basic information

CAS: 4167-10-6
Standard SMILES: CC(C)(O)P(=O)(O)O
InChIKey: BIUOBUYYANSOMD-UHFFFAOYSA-N
Molecular formula: C3H9O4P
Average molar mass: 140.07 g/mol
Monoisotopic mass: 140.02384576

Names & identifiers

Preferred name: 2-Hydroxypropan-2-ylphosphonic acid
IUPAC: 2-hydroxypropan-2-ylphosphonic acid

Names & synonyms

2-hydroxypropan-2-ylphosphonic acid4167-10-6DTXSID90331335RefChem:261913DTXCID40282429NSC518119SCHEMBL4649888(2-Hydroxypropan-2-yl)phosphonic acidNSC-518119DB-217392

Database identifiers

CAS: 4167-10-6
PubChem CID: 437512
DTXSID: DTXSID90331335

Properties

Computed structural properties

XLogP: -1.6
Topological polar surface area: 77.8 Å²
Hydrogen bond donors: 3
Hydrogen bond acceptors: 4
Rotatable bonds: 1
Heavy atoms: 8
Formal charge: 0
Complexity: 123

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Compound notes

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