Chemical Properties of Benzoic acid, undecyl ester (CAS 6316-30-9)

Benzoic acid, undecyl ester

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InChI
InChI=1S/C18H28O2/c1-2-3-4-5-6-7-8-9-13-16-20-18(19)17-14-11-10-12-15-17/h10-12,14-15H,2-9,13,16H2,1H3
InChI Key
YEHGKFOTJWYCBN-UHFFFAOYSA-N
Formula
C18H28O2
SMILES
CCCCCCCCCCCOC(=O)c1ccccc1
Molecular Weight1
276.41
CAS
6316-30-9
Other Names
  • undecyl benzoate
Sources

Physical Properties

Property Value Unit Source
Δf -20.83 kJ/mol Joback Calculated Property
Δfgas -423.12 kJ/mol Joback Calculated Property
Δfus 39.20 kJ/mol Joback Calculated Property
Δvap 67.09 kJ/mol Joback Calculated Property
logPoct/wat 5.37 Crippen Calculated Property
Pc 1515.21 kPa Joback Calculated Property
Tboil 714.21 K Joback Calculated Property
Tc 906.19 K Joback Calculated Property
Tfus 391.20 K Joback Calculated Property
Vc 0.96 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 710.91 J/mol×K 714.21 Joback Calculated Property
η 0.00 Pa×s 714.21 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
>C=O (nonring) 1
=CH- (ring) 5
=C< (ring) 1
-CH2- 10
-CH3 1

Similar Compounds

Benzoic acid, octadecyl ester. Benzoic acid, eicosyl ester. Behenyl benzoate. decyl benzoate. Benzoic acid, hexadecyl ester. dodecyl benzoate. nonyl benzoate. Benzoic acid, nonadecyl ester. Benzoic acid, tridecyl ester. Benzoic acid, pentadecyl ester. Benzoic acid, octyl ester. Benzoic acid, tetradecyl ester. Benzoic acid, heptadecyl ester. Tetracosyl benzoate. Eicosyl benzoate.

Find more compounds similar to Benzoic acid, undecyl ester.

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