Hexadecyl hexadecenoate
Basic information
- CAS
71788-99-3- Standard SMILES
CCCCCCCCCCCCCC=CC(=O)OCCCCCCCCCCCCCCCC- InChIKey
TYCWLPZLNYBZLD-SJCQXOIGSA-N- Molecular formula
- C32H62O2
- Average molar mass
- 478.8 g/mol
- Monoisotopic mass
- 478.47498122
Names & identifiers
- Preferred name
- Hexadecyl hexadecenoate
- IUPAC
- hexadecyl hexadec-2-enoate
- English name
- hexadecyl hexadecenoate
- Molecular formula
- C32H62O2
- Molecular weight
- 478.83348
Names & synonyms
Hexadecyl hexadecenoate71788-99-3EINECS 276-019-5SCHEMBL10852072TYCWLPZLNYBZLD-UHFFFAOYSA-NNS00063518Hexadecenoic acid,hexadecyl ester (9CI)
Database identifiers
- CAS
71788-99-3- PubChem CID
- 53436617
- EC Number
- 276-019-5
Properties
Computed structural properties
- XLogP
- 15.1
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 29
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 415
Physicochemical properties
- LogP
- 15.053 · 15.053 (est)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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