Chemical Properties of Glutaric acid, isohexyl trans-hex-3-enyl ester

Glutaric acid, isohexyl trans-hex-3-enyl ester

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InChI
InChI=1S/C17H30O4/c1-4-5-6-7-13-20-16(18)11-8-12-17(19)21-14-9-10-15(2)3/h5-6,15H,4,7-14H2,1-3H3/b6-5+
InChI Key
YMRSDUFYLVWVAV-AATRIKPKSA-N
Formula
C17H30O4
SMILES
CCC=CCCOC(=O)CCCC(=O)OCCCC(C)C
Molecular Weight1
298.42
Sources

Physical Properties

Property Value Unit Source
Δf -297.80 kJ/mol Joback Calculated Property
Δfgas -771.87 kJ/mol Joback Calculated Property
Δfus 42.04 kJ/mol Joback Calculated Property
Δvap 71.32 kJ/mol Joback Calculated Property
logPoct/wat 4.04 Crippen Calculated Property
Pc 1373.78 kPa Joback Calculated Property
Tboil 744.66 K Joback Calculated Property
Tc 927.57 K Joback Calculated Property
Tfus 405.59 K Joback Calculated Property
Vc 1.01 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 767.78 J/mol×K 744.66 Joback Calculated Property
η 0.00 Pa×s 744.66 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 2
-CH3 3
-CH2- 9
=CH- 2
>C=O (nonring) 2

Similar Compounds

Glutaric acid, cis-hex-3-enyl isohexyl ester. Glutraic acid, cis-non-3-enyl isohexyl ester. Glutaric acid, cis-hex-3-enyl pentyl ester. Glutaric acid, pentyl trans-hex-3-enyl ester. Glutaric acid, butyl trans-hex-3-enyl ester. Glutaric acid, butyl cis-hex-3-enyl ester. Glutaric acid, isohexyl tetradec-3-enyl ester. Glutaric acid, cis-hex-3-enyl propyl ester. Glutaric acid, di(trans-hex-3-enyl) ester. Glutaric acid, cis-hex-3-enyl ethyl ester. Glutaric acid, di(cis-hex-3-enyl) ester. Glutaric acid, propyl trans-hex-3-enyl ester. Glutaric acid, ethyl trans-hex-3-enyl ester. Glutaric acid, heptyl trans-hex-3-enyl ester. Glutaric acid, cis-hex-3-enyl heptyl ester.

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