Chemical Properties of dodecyl benzoate (CAS 2915-72-2)

dodecyl benzoate

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InChI
InChI=1S/C19H30O2/c1-2-3-4-5-6-7-8-9-10-14-17-21-19(20)18-15-12-11-13-16-18/h11-13,15-16H,2-10,14,17H2,1H3
InChI Key
DLAHAXOYRFRPFQ-UHFFFAOYSA-N
Formula
C19H30O2
SMILES
CCCCCCCCCCCCOC(=O)c1ccccc1
Molecular Weight1
290.44
CAS
2915-72-2
Other Names
  • Benzoic acid, dodecyl ester
Sources

Physical Properties

Property Value Unit Source
Δf -12.41 kJ/mol Joback Calculated Property
Δfgas -443.76 kJ/mol Joback Calculated Property
Δfus 41.79 kJ/mol Joback Calculated Property
Δvap 69.32 kJ/mol Joback Calculated Property
logPoct/wat 5.76 Crippen Calculated Property
Pc 1408.01 kPa Joback Calculated Property
Tboil 737.09 K Joback Calculated Property
Tc 928.11 K Joback Calculated Property
Tfus 402.47 K Joback Calculated Property
Vc 1.02 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 768.05 J/mol×K 737.09 Joback Calculated Property
η 0.00 Pa×s 737.09 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
>C=O (nonring) 1
=CH- (ring) 5
=C< (ring) 1
-CH2- 11
-CH3 1

Similar Compounds

Benzoic acid, octadecyl ester. Benzoic acid, eicosyl ester. Behenyl benzoate. Benzoic acid, undecyl ester. decyl benzoate. Benzoic acid, hexadecyl ester. 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.

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