Basic information
- CAS
2388-76-3- Standard SMILES
CCCCCCCCCC(=O)CCCCCCCCCC(=O)OC- InChIKey
YETUXOMVCLUZSZ-UHFFFAOYSA-N- Molecular formula
- C21H40O3
- Average molar mass
- 340.5 g/mol
- Monoisotopic mass
- 340.29774513
Names & identifiers
- Preferred name
- Eicosanoic acid, 11-oxo-, methyl ester
- IUPAC
- methyl 11-oxoicosanoate
- English name
- 11-Oxoicosanoic acid methyl ester
- Molecular formula
- C21H40O3
- Molecular weight
- 340.54
Names & synonyms
Eicosanoic acid, 11-oxo-, methyl ester2388-76-3Methyl 11-oxoicosanoateMethyl 11-oxoeicosanoate11-Oxoicosanoic acid methyl esterMethyl 11-oxoicosanoate #DTXSID40344617YETUXOMVCLUZSZ-UHFFFAOYSA-N11-Ketoarachic acid methyl ester
Database identifiers
- CAS
2388-76-3- PubChem CID
- 598337
- DTXSID
DTXSID40344617- Nikkaji
- J117.931D
Properties
Computed structural properties
- XLogP
- 7.2
- Topological polar surface area
- 43.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 19
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 299
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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