Chemical Properties of 4-Butylbenzoic acid, pentadecyl ester

4-Butylbenzoic acid, pentadecyl ester

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InChI
InChI=1S/C26H44O2/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-23-28-26(27)25-21-19-24(20-22-25)18-6-4-2/h19-22H,3-18,23H2,1-2H3
InChI Key
BHJAAVUAXRALDM-UHFFFAOYSA-N
Formula
C26H44O2
SMILES
CCCCCCCCCCCCCCCOC(=O)c1ccc(CCCC)cc1
Molecular Weight1
388.63
Sources

Physical Properties

Property Value Unit Source
Δf 36.90 kJ/mol Joback Calculated Property
Δfgas -599.71 kJ/mol Joback Calculated Property
Δfus 59.53 kJ/mol Joback Calculated Property
Δvap 85.56 kJ/mol Joback Calculated Property
logPoct/wat 8.28 Crippen Calculated Property
Pc 890.00 kPa Joback Calculated Property
Tboil 902.23 K Joback Calculated Property
Tc 1104.96 K Joback Calculated Property
Tfus 493.88 K Joback Calculated Property
Vc 1.41 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1192.67 J/mol×K 902.23 Joback Calculated Property
η 0.00 Pa×s 902.23 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-CH3 2
=CH- (ring) 4
=C< (ring) 2
-CH2- 17
>C=O (nonring) 1

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, tetradecyl ester. 4-Butylbenzoic acid, nonyl ester. 4-Butylbenzoic acid, heptadecyl 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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