Chemical Properties of Bis(3-methylbutan-2-yl) phthalate

Bis(3-methylbutan-2-yl) phthalate

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InChI
InChI=1S/C18H26O4/c1-11(2)13(5)21-17(19)15-9-7-8-10-16(15)18(20)22-14(6)12(3)4/h7-14H,1-6H3
InChI Key
KYBCYUKYPGQBSB-UHFFFAOYSA-N
Formula
C18H26O4
SMILES
CC(C)C(C)OC(=O)c1ccccc1C(=O)OC(C)C(C)C
Molecular Weight1
306.40
Other Names
  • 1,2-Benzenedicarboxylic acid, bis(3-methylbutan-2-yl) ester
  • Bis(3-methylbutan-2-yl)-1,2-benzenedicarboxylate
Sources

Physical Properties

Property Value Unit Source
Δf -274.14 kJ/mol Joback Calculated Property
Δfgas -700.51 kJ/mol Joback Calculated Property
Δfus 27.51 kJ/mol Joback Calculated Property
Δvap 75.36 kJ/mol Joback Calculated Property
logPoct/wat 4.09 Crippen Calculated Property
Pc 1592.35 kPa Joback Calculated Property
Tboil 793.72 K Joback Calculated Property
Tc 1003.71 K Joback Calculated Property
Tfus 415.88 K Joback Calculated Property
Vc 0.96 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 763.39 J/mol×K 793.72 Joback Calculated Property
η 0.00 Pa×s 793.72 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 4
-O- (nonring) 2
-CH3 6
=CH- (ring) 4
=C< (ring) 2
>C=O (nonring) 2

Similar Compounds

2-((3-Methylbutan-2-yloxy)carbonyl)benzoic acid. Phthalic acid, di(2-methylpent-3-yl) ester. Phthalic acid, di(3,3-dimethylbut-2-yl) ester. Phthalic acid, ethyl 2-methylpent-3-yl ester. Phthalic acid, 3,3-dimethylbut-2-yl isobutyl ester. Phthalic acid, 2-methylpent-3-yl propyl ester. Phthalic acid, isobutyl 2-methylpent-3-yl ester. Phthalic acid, di(2,4-dimethylpent-3-yl) ester. Phthalic acid, 2,4-dimethylpent-3-yl propyl ester. Phthalic acid, 2,4-dimethylpent-3-yl isobutyl ester. Phthalic acid, 2,4-dimethylpent-3-yl ethyl ester. Di-sec-butyl phthalate. Phthalic acid, butyl 2-methylpent-3-yl ester. Phthalic acid, butyl 3,3-dimethylbut-2-yl ester. Phthalic acid, di(2,2-dimethylpent-3-yl) ester.

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