Basic information
- CAS
92857-56-2- Standard SMILES
CC(=O)OCCCCCCCCCCCCC=O- InChIKey
XTZKYRWAGUDDLK-UHFFFAOYSA-N- Molecular formula
- C15H28O3
- Average molar mass
- 256.38 g/mol
- Monoisotopic mass
- 256.20384475
Names & identifiers
- Preferred name
- 13-Oxotridecyl acetate
- IUPAC
- 13-oxotridecyl acetate
- English name
- 13-Acetyloxytridecanal
- Molecular formula
- C15H28O3
- Molecular weight
- 256.38102
Names & synonyms
13-acetyloxytridecanal13-oxotridecyl acetateSCHEMBL1300597XTZKYRWAGUDDLK-UHFFFAOYSA-N
Database identifiers
- CAS
92857-56-2- PubChem CID
- 19915366
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 43.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 14
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 202
Related reactions
1 records
Compound notes
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