Chemical Properties of 10,14-Dimethylpentadecyl isobutyrate

10,14-Dimethylpentadecyl isobutyrate

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InChI
InChI=1S/C21H42O2/c1-18(2)14-13-16-20(5)15-11-9-7-6-8-10-12-17-23-21(22)19(3)4/h18-20H,6-17H2,1-5H3
InChI Key
WEUUVFYXSHQOIT-UHFFFAOYSA-N
Formula
C21H42O2
SMILES
CC(C)CCCC(C)CCCCCCCCCOC(=O)C(C)C
Molecular Weight1
326.56
Sources

Physical Properties

Property Value Unit Source
Δf -115.30 kJ/mol Joback Calculated Property
Δfgas -737.41 kJ/mol Joback Calculated Property
Δfus 42.36 kJ/mol Joback Calculated Property
Δvap 70.33 kJ/mol Joback Calculated Property
logPoct/wat 6.77 Crippen Calculated Property
Pc 998.91 kPa Joback Calculated Property
Tboil 754.85 K Joback Calculated Property
Tc 931.67 K Joback Calculated Property
Tfus 353.59 K Joback Calculated Property
Vc 1.22 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 970.62 J/mol×K 754.85 Joback Calculated Property
η 0.00 Pa×s 754.85 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 3
-O- (nonring) 1
-CH2- 12
>C=O (nonring) 1
-CH3 5

Similar Compounds

Propanoic acid, 2-methyl-, decyl ester. Propanoic acid, 2-methyl-, octyl ester. Propanoic acid, 2-methyl-, nonyl ester. Eicosyl isobutyrate. Propanoic acid, 2-methyl-, heptyl ester. 4-Methylhexyl isobutyrate. Propanoic acid, 2-methyl-, hexyl ester. 6-Methylheptyl 2-methylbutanoate. 4-methylpentyl isobutyrate. Propanoic acid, 2-methyl-, pentyl ester. Isobutyric acid, 8-chlorooctyl ester. Propanoic acid, 2,2-dimethyl-, heptyl ester. 2-methylheptyl propanoate. Decyl 2-methylbutanoate. Butanoic acid, 2-methyl-, octyl ester.

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