Chemical Properties of Propanoic acid, hexadecyl ester (CAS 6221-96-1)

Propanoic acid, hexadecyl ester

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InChI
InChI=1S/C19H38O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-19(20)4-2/h3-18H2,1-2H3
InChI Key
RSRQBSGZMPVCOI-UHFFFAOYSA-N
Formula
C19H38O2
SMILES
CCCCCCCCCCCCCCCCOC(=O)CC
Molecular Weight1
298.50
CAS
6221-96-1
Other Names
  • 1-Hexadecanol, propanoate
  • Hexadecyl propionate
  • propionic acid, hexadecyl ester
Sources

Physical Properties

Property Value Unit Source
Δf -124.82 kJ/mol Joback Calculated Property
Δfgas -680.29 kJ/mol Joback Calculated Property
Δfus 47.75 kJ/mol Joback Calculated Property
Δvap 67.04 kJ/mol Joback Calculated Property
logPoct/wat 6.42 Crippen Calculated Property
Pc 1114.08 kPa Joback Calculated Property
Tboil 710.41 K Joback Calculated Property
Tc 879.90 K Joback Calculated Property
Tfus 376.05 K Joback Calculated Property
Vc 1.12 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 848.69 J/mol×K 710.41 Joback Calculated Property
η 0.00 Pa×s 710.41 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-CH2- 16
>C=O (nonring) 1
-CH3 2

Similar Compounds

Propanoic acid, decyl ester. 1-Docosanol, propanoate. Propanoic acid, octadecyl ester. PROPANOIC ACID, NONYL ESTER. Propanoic acid, tetradecyl ester. Propanoic acid, undecyl ester. Eicosanyl propionate. Dodecyl propionate. Propanoic acid, octyl ester. Propanoic acid, heptyl ester. Propanoic acid, hexyl ester. Butyric acid, pentadecyl ester. Butanoic acid, octyl ester. Butanoic acid, undecyl ester. Butyric acid, hexadecyl ester.

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