Chemical Properties of 4-Butylbenzoic acid, heptadecyl ester

4-Butylbenzoic acid, heptadecyl ester

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InChI
InChI=1S/C28H48O2/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-25-30-28(29)27-23-21-26(22-24-27)20-6-4-2/h21-24H,3-20,25H2,1-2H3
InChI Key
VRWCPSOWOJJUQU-UHFFFAOYSA-N
Formula
C28H48O2
SMILES
CCCCCCCCCCCCCCCCCOC(=O)c1ccc(CCCC)cc1
Molecular Weight1
416.68
Sources

Physical Properties

Property Value Unit Source
Δf 53.74 kJ/mol Joback Calculated Property
Δfgas -640.99 kJ/mol Joback Calculated Property
Δfus 64.72 kJ/mol Joback Calculated Property
Δvap 90.02 kJ/mol Joback Calculated Property
logPoct/wat 9.06 Crippen Calculated Property
Pc 796.18 kPa Joback Calculated Property
Tboil 947.99 K Joback Calculated Property
Tc 1161.23 K Joback Calculated Property
Tfus 516.42 K Joback Calculated Property
Vc 1.52 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1320.05 J/mol×K 947.99 Joback Calculated Property
η 0.00 Pa×s 947.99 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
>C=O (nonring) 1
=CH- (ring) 4
=C< (ring) 2
-CH2- 19
-CH3 2

Similar Compounds

4-Butylbenzoic acid, octyl ester. 4-Butylbenzoic acid, tridecyl ester. 4-Butylbenzoic acid, octadecyl ester. 4-Butylbenzoic acid, hexadecyl ester. 4-Butylbenzoic acid, decyl ester. 4-Butylbenzoic acid, pentadecyl ester. 4-Butylbenzoic acid, tetradecyl ester. 4-Butylbenzoic acid, nonyl ester. 4-Butylbenzoic acid, undecyl ester. 4-Butylbenzoic acid, heptyl ester. 4-Butylbenzoic acid, hexyl ester. 4-Butylbenzoic acid, pentyl ester. 4-Butylbenzoic acid, 8-chlorooctyl ester. 4-Butylbenzoic acid, dodec-9-ynyl ester. 4-Butylbenzoic acid, 2-methylpentyl ester.

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