Chemical Properties of Hydratropic acid, hexadecyl ester

Hydratropic acid, hexadecyl ester

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InChI
InChI=1S/C25H42O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22-27-25(26)23(2)24-20-17-16-18-21-24/h16-18,20-21,23H,3-15,19,22H2,1-2H3
InChI Key
OJOVCGNNBABGAZ-UHFFFAOYSA-N
Formula
C25H42O2
SMILES
CCCCCCCCCCCCCCCCOC(=O)C(C)c1ccccc1
Molecular Weight1
374.60
Sources

Physical Properties

Property Value Unit Source
Δf 35.67 kJ/mol Joback Calculated Property
Δfgas -572.88 kJ/mol Joback Calculated Property
Δfus 53.81 kJ/mol Joback Calculated Property
Δvap 82.29 kJ/mol Joback Calculated Property
logPoct/wat 7.81 Crippen Calculated Property
Pc 956.73 kPa Joback Calculated Property
Tboil 873.93 K Joback Calculated Property
Tc 1072.51 K Joback Calculated Property
Tfus 455.09 K Joback Calculated Property
Vc 1.35 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1130.30 J/mol×K 873.93 Joback Calculated Property
η 0.00 Pa×s 873.93 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 1
-CH3 2
=CH- (ring) 5
=C< (ring) 1
-CH2- 15
>C=O (nonring) 1

Similar Compounds

Hydratropic acid, octyl ester. Hydratropic acid, heptadecyl ester. Hydratropic acid, tridecyl ester. Hydratropic acid, nonyl ester. Hydratropic acid, dodecyl ester. Hydratropic acid, tetradecyl ester. Hydratropic acid, octadecyl ester. Hydratropic acid, pentadecyl ester. Hydratropic acid, undecyl ester. Hydratropic acid, decyl ester. Hydratropic acid, heptyl ester. Hydratropic acid, hexyl ester. Hydratropic acid, pentyl ester. Hydratropic acid, isohexyl ester. Hydratropic acid, butyl ester.

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