Basic information
- CAS
21308-79-2- Standard SMILES
CCCCCCC(=O)/C=C/CCCCCCCCC(=O)OC- InChIKey
OHJIOGJOUIOUTD-DTQAZKPQSA-N- Molecular formula
- C19H34O3
- Average molar mass
- 310.5 g/mol
- Monoisotopic mass
- 310.25079494
Overview
structure
Names & identifiers
- Preferred name
- Methyl-12-oxo-trans-10-octadecenoate
- IUPAC
- methyl (E)-12-oxooctadec-10-enoate
Names & synonyms
DTXSID6020854Methyl-12-oxo-trans-10-octadecenoateRefChem:925752DTXCID0085421308-79-2Methyl 12-oxo-trans-10-octadecenoatemethyl (10E)-12-oxooctadec-10-enoate
Database identifiers
- CAS
21308-79-2- PubChem CID
- 5284424
- DTXSID
DTXSID6020854- Nikkaji
- J42.507I
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 43.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 16
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 308
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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