11-Oxooctadec-9-enoic acid
Basic information
- CAS
99640-13-8- Standard SMILES
CCCCCCCC(=O)C=CCCCCCCCC(=O)O- InChIKey
RUZUHRFUQOHDQB-UHFFFAOYSA-N- Molecular formula
- C18H32O3
- Average molar mass
- 296.4 g/mol
- Monoisotopic mass
- 296.23514488
Names & identifiers
- Preferred name
- 11-Oxooctadec-9-enoic acid
- IUPAC
- 11-oxooctadec-9-enoic acid
Names & synonyms
11-OXOOCTADEC-9-ENOIC ACID99640-13-8DTXSID40710333
Database identifiers
- CAS
99640-13-8- PubChem CID
- 54287247
- DTXSID
DTXSID40710333
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 54.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 15
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 295
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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