Basic information
- CAS
128317-03-3- Standard SMILES
CCCC(O)CC(=O)CCC(=O)O- InChIKey
MICRRSRTOYVLMG-UHFFFAOYSA-N- Molecular formula
- C9H16O4
- Average molar mass
- 188.22 g/mol
- Monoisotopic mass
- 188.10485899
Names & identifiers
- Preferred name
- 6-Hydroxy-4-oxononanoic acid
- IUPAC
- 6-hydroxy-4-oxononanoic acid
Names & synonyms
128317-03-36-hydroxy-4-oxononanoic acidSCHEMBL4774159DTXSID40562218
Database identifiers
- CAS
128317-03-3- PubChem CID
- 14616481
- DTXSID
DTXSID40562218- Nikkaji
- J315.880B
Properties
Computed structural properties
- XLogP
- -0.1
- Topological polar surface area
- 74.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 176
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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