Chemical Properties of Adipic acid, 3-methylpentyl pentyl ester

Adipic acid, 3-methylpentyl pentyl ester

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InChI
InChI=1S/C17H32O4/c1-4-6-9-13-20-16(18)10-7-8-11-17(19)21-14-12-15(3)5-2/h15H,4-14H2,1-3H3
InChI Key
QHPFXPMEYXUDFH-UHFFFAOYSA-N
Formula
C17H32O4
SMILES
CCCCCOC(=O)CCCCC(=O)OCCC(C)CC
Molecular Weight1
300.43
Sources

Physical Properties

Property Value Unit Source
Δf -378.02 kJ/mol Joback Calculated Property
Δfgas -889.09 kJ/mol Joback Calculated Property
Δfus 41.84 kJ/mol Joback Calculated Property
Δvap 71.36 kJ/mol Joback Calculated Property
logPoct/wat 4.26 Crippen Calculated Property
Pc 1322.31 kPa Joback Calculated Property
Tboil 740.50 K Joback Calculated Property
Tc 919.30 K Joback Calculated Property
Tfus 410.67 K Joback Calculated Property
Vc 1.03 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 791.52 J/mol×K 740.5 Joback Calculated Property
η 0.00 Pa×s 740.5 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 2
-CH2- 11
>C=O (nonring) 2
-CH3 3

Similar Compounds

Adipic acid, hexyl 3-methylpentyl ester. Adipic acid, 3-methylpentyl propyl ester. Adipic acid, butyl 3-methylpentyl ester. Adipic acid, ethyl 3-methylpentyl ester. Adipic acid, di(3-methylpentyl) ester. Adipic acid, heptyl 3-methylpentyl ester. Adipic acid, 3-methylpentyl octyl ester. Adipic acid, heptadecyl 3-methylpentyl ester. Adipic acid, dodecyl 3-methylpentyl ester. Adipic acid, 3-methylpentyl pentadecyl ester. Adipic acid, 3-methylpentyl nonadecyl ester. Adipic acid, hexadecyl 3-methylpentyl ester. Adipic acid, 3-methylpentyl undecyl ester. Adipic acid, 3-methylpentyl nonyl ester. Adipic acid, eicosyl 3-methylpentyl ester.

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