N-(Octadec-9-EN-1-YL)hexadecanamide
Basic information
- CAS
96674-02-1- Standard SMILES
CCCCCCCCC=CCCCCCCCCNC(=O)CCCCCCCCCCCCCCC- InChIKey
VMRGZRVLZQSNHC-UHFFFAOYSA-N- Molecular formula
- C34H67NO
- Average molar mass
- 505.9 g/mol
- Monoisotopic mass
- 505.52226576
Names & identifiers
- Preferred name
- N-(Octadec-9-EN-1-YL)hexadecanamide
- IUPAC
- N-octadec-9-enylhexadecanamide
- English name
- Oleyl palmitamide
- Molecular formula
- C34H67NO
- Molecular weight
- 505.9
Names & synonyms
SCHEMBL264422VMRGZRVLZQSNHC-UHFFFAOYSA-NN-(OCTADEC-9-EN-1-YL)HEXADECANAMIDENS00077357N-octadec-9-enylhexadecanamideHexadecanamide, N-9-octadecen-1-yl-
Database identifiers
- CAS
96674-02-1- PubChem CID
- 85350
- DTXSID
DTXSID20275819
Properties
Computed structural properties
- XLogP
- 14.8
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 30
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 444
Physicochemical properties
- Boiling point
- 618.6 · 618.6±34.0 °C(Predicted)
- Density
- 0.858 · 0.858±0.06 g/cm3(Predicted)
- pka
- 16.43 · 16.43±0.46(Predicted)
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Compound notes
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