Chemical Properties of 4-Butylbenzoic acid, tridecyl ester

4-Butylbenzoic acid, tridecyl ester

Download as PDF file Download as Excel file Download as 2D mole file Predict properties

InChI
InChI=1S/C24H40O2/c1-3-5-7-8-9-10-11-12-13-14-15-21-26-24(25)23-19-17-22(18-20-23)16-6-4-2/h17-20H,3-16,21H2,1-2H3
InChI Key
NVRBFKXQEWUCOB-UHFFFAOYSA-N
Formula
C24H40O2
SMILES
CCCCCCCCCCCCCOC(=O)c1ccc(CCCC)cc1
Molecular Weight1
360.57
Sources

Physical Properties

Property Value Unit Source
Δf 20.06 kJ/mol Joback Calculated Property
Δfgas -558.43 kJ/mol Joback Calculated Property
Δfus 54.35 kJ/mol Joback Calculated Property
Δvap 81.11 kJ/mol Joback Calculated Property
logPoct/wat 7.497 Crippen Calculated Property
Pc 1001.44 kPa Joback Calculated Property
Tboil 856.47 K Joback Calculated Property
Tc 1052.40 K Joback Calculated Property
Tfus 471.34 K Joback Calculated Property
Vc 1.296 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1067.56 J/mol×K 856.47 Joback Calculated Property
η 0.0000433 Pa×s 856.47 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
>C=O (nonring) 1
=CH- (ring) 4
=C< (ring) 2
-CH2- 15
-CH3 2

Similar Compounds

4-Butylbenzoic acid, octyl 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, 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.

Find more compounds similar to 4-Butylbenzoic acid, tridecyl ester.

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.