Chemical Properties of 4-Butylbenzoic acid, decyl ester

4-Butylbenzoic acid, decyl ester

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InChI
InChI=1S/C21H34O2/c1-3-5-7-8-9-10-11-12-18-23-21(22)20-16-14-19(15-17-20)13-6-4-2/h14-17H,3-13,18H2,1-2H3
InChI Key
CLFVRPLNUBPRAQ-UHFFFAOYSA-N
Formula
C21H34O2
SMILES
CCCCCCCCCCOC(=O)c1ccc(CCCC)cc1
Molecular Weight1
318.49
Sources

Physical Properties

Property Value Unit Source
Δf -5.20 kJ/mol Joback Calculated Property
Δfgas -496.51 kJ/mol Joback Calculated Property
Δfus 46.58 kJ/mol Joback Calculated Property
Δvap 74.43 kJ/mol Joback Calculated Property
logPoct/wat 6.327 Crippen Calculated Property
Pc 1212.36 kPa Joback Calculated Property
Tboil 787.83 K Joback Calculated Property
Tc 979.38 K Joback Calculated Property
Tfus 437.53 K Joback Calculated Property
Vc 1.127 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 885.17 J/mol×K 787.83 Joback Calculated Property
η 0.0000653 Pa×s 787.83 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
>C=O (nonring) 1
=CH- (ring) 4
=C< (ring) 2
-CH2- 12
-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, pentadecyl 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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