(11Z,13E)-icosa-11,13-dienoic Acid
Basic information
- CAS
105835-45-8- Standard SMILES
CCCCCC/C=C/C=C\CCCCCCCCCC(=O)O- InChIKey
UNFHLCKMPAPDAZ-GOJKSUSPSA-N- Molecular formula
- C20H36O2
- Average molar mass
- 308.5 g/mol
- Monoisotopic mass
- 308.27153039
Names & identifiers
- Preferred name
- (11Z,13E)-icosa-11,13-dienoic Acid
- IUPAC
- (11Z,13E)-icosa-11,13-dienoic acid
Names & synonyms
(11Z,13E)-icosa-11,13-dienoic AcidCHEMBL313436SCHEMBL7199200DTXSID701296908(11Z,13E)-11,13-Eicosadienoic acid105835-45-8
Database identifiers
- CAS
105835-45-8- PubChem CID
- 9818092
- DTXSID
DTXSID701296908- ChEMBL
CHEMBL313436- Nikkaji
- J2.152.984B
Properties
Computed structural properties
- XLogP
- 7.2
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 16
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 292
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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