(5R)-5-Hydroxy-3-oxohexanoic acid
Basic information
- CAS
821772-72-9- Standard SMILES
C[C@@H](O)CC(=O)CC(=O)O- InChIKey
ZQPJZYKENZNLOW-SCSAIBSYSA-N- Molecular formula
- C6H10O4
- Average molar mass
- 146.14 g/mol
- Monoisotopic mass
- 146.0579088
Names & identifiers
- Preferred name
- (5R)-5-Hydroxy-3-oxohexanoic acid
- IUPAC
- (5R)-5-hydroxy-3-oxohexanoic acid
Names & synonyms
(5R)-5-Hydroxy-3-oxohexanoic acid821772-72-9SCHEMBL7781837DTXSID70839167
Database identifiers
- CAS
821772-72-9- PubChem CID
- 71419952
- DTXSID
DTXSID70839167
Properties
Computed structural properties
- XLogP
- -0.7
- Topological polar surface area
- 74.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 141
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Compound notes
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