Basic information
- CAS
211486-96-3- Standard SMILES
CC(C)CCCCCCCCCCCCC(=O)OC(C)C- InChIKey
CXHAYMQVPFWTFL-UHFFFAOYSA-N- Molecular formula
- C19H38O2
- Average molar mass
- 298.5 g/mol
- Monoisotopic mass
- 298.28718045
Names & identifiers
- Preferred name
- i-Propyl 14-methyl-pentadecanoate
- IUPAC
- propan-2-yl 14-methylpentadecanoate
Names & synonyms
SCHEMBL14848943CXHAYMQVPFWTFL-UHFFFAOYSA-NDTXSID101366220i-Propyl 14-methyl-pentadecanoatePentadecanoic acid, 14-methyl-, 1-methylethyl ester211486-96-3
Database identifiers
- CAS
211486-96-3- PubChem CID
- 53745103
- DTXSID
DTXSID101366220
Properties
Computed structural properties
- XLogP
- 8
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 15
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 234
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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