chempirical

Hexadecyl acrylate

C19H36O2CAS 13402-02-3296.50 g/mol

Open in Covalent MOL file
OO
AlkeneEster

Properties

Molecular formula
C19H36O2
Molar mass
296.50 g/mol
Exact mass
296.2715 Da
Density
0.8628 g/mL (at 30 °C)
Melting point
24 °C
Boiling point
148 °C (at 0.04 Torr)
logP
6.20Crippen estimate
Polar surface area
26.3 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
16

Identifiers

CAS number
13402-02-3
SMILES
C=CC(=O)OCCCCCCCCCCCCCCCC
InChIKey
PZDUWXKXFAIFOR-UHFFFAOYSA-N
InChI
InChI=1S/C19H36O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-19(20)4-2/h4H,2-3,5-18H2,1H3

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Names and synonyms

11 names
  • 2-Propenoic acid, hexadecyl ester
  • Cetyl acrylate
  • n-Hexadecyl acrylate
  • NSC 72788
  • Photomer 4816
  • Hexadecanyl acrylate
  • CD 585
  • Blemmer CA
  • Acrylic acid, hexadecyl ester
  • 1-Hexadecanol, acrylate
  • Palmityl acrylate

Work with Hexadecyl acrylate

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Decyl acrylate2156-96-9100 % similar Lauryl acrylate2156-97-0100 % similar Octyl acrylate2499-59-4100 % similar Hexyl acrylate2499-95-8100 % similar Stearyl acrylate4813-57-4100 % similar 1,6-Hexanediol diacrylate13048-33-478 % similar 1,4-Butylene glycol diacrylate1070-70-874 % similar Di-N-octyl maleate2915-53-970 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Methyl oleate112-62-9 Methyl elaidate1937-62-8

Elsewhere

PubChem CAS Common Chemistry NIST WebBook