Chemical Properties of p-Toluic acid, nonyl ester

p-Toluic acid, nonyl ester

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InChI
InChI=1S/C17H26O2/c1-3-4-5-6-7-8-9-14-19-17(18)16-12-10-15(2)11-13-16/h10-13H,3-9,14H2,1-2H3
InChI Key
KKKOQJXGARKBNU-UHFFFAOYSA-N
Formula
C17H26O2
SMILES
CCCCCCCCCOC(=O)c1ccc(C)cc1
Molecular Weight1
262.39
Other Names
  • p-toluylic acid, nonyl ester
Sources

Physical Properties

Property Value Unit Source
Δf -38.88 kJ/mol Joback Calculated Property
Δfgas -413.95 kJ/mol Joback Calculated Property
Δfus 36.22 kJ/mol Joback Calculated Property
Δvap 65.53 kJ/mol Joback Calculated Property
logPoct/wat 4.90 Crippen Calculated Property
Pc 1615.47 kPa Joback Calculated Property
Tboil 696.31 K Joback Calculated Property
Tc 890.56 K Joback Calculated Property
Tfus 392.45 K Joback Calculated Property
Vc 0.90 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 654.61 J/mol×K 696.31 Joback Calculated Property
η 0.00 Pa×s 696.31 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-CH3 2
=CH- (ring) 4
=C< (ring) 2
-CH2- 8
>C=O (nonring) 1

Similar Compounds

P-toluic acid, tridecyl ester. P-toluic acid, octyl ester. P-toluic acid, decyl ester. p-Toluic acid, octadecyl ester. p-Toluic acid, heptadecyl ester. Hexadecyl p-toluate. p-Toluic acid, pentadecyl ester. P-toluic acid, tetradecyl ester. P-toluic acid, undecyl ester. p-Toluic acid, heptyl ester. P-toluic acid, hexyl ester. Butyl octyl terephthalate. 1,4-Benzenedicarboxylic acid, dioctyl ester. 1,4-Benzenedicarboxylic acid, decyl ethyl ester. Terephthalic acid, methyl undecyl ester.

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