Chemical Properties of Dimethylmalonic acid, butyl 4-(4-methoxyphenyl)cyclohexyl ester

Dimethylmalonic acid, butyl 4-(4-methoxyphenyl)cyclohexyl ester

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InChI
InChI=1S/C22H32O5/c1-5-6-15-26-20(23)22(2,3)21(24)27-19-13-9-17(10-14-19)16-7-11-18(25-4)12-8-16/h7-8,11-12,17,19H,5-6,9-10,13-15H2,1-4H3
InChI Key
SNADJYBKZGAIDL-UHFFFAOYSA-N
Formula
C22H32O5
SMILES
CCCCOC(=O)C(C)(C)C(=O)OC1CCC(c2ccc(OC)cc2)CC1
Molecular Weight1
376.49
Sources

Physical Properties

Property Value Unit Source
Δf -316.12 kJ/mol Joback Calculated Property
Δfgas -868.94 kJ/mol Joback Calculated Property
Δfus 38.64 kJ/mol Joback Calculated Property
Δvap 87.05 kJ/mol Joback Calculated Property
logPoct/wat 4.63 Crippen Calculated Property
Pc 1324.24 kPa Joback Calculated Property
Tboil 921.07 K Joback Calculated Property
Tc 1144.76 K Joback Calculated Property
Tfus 548.75 K Joback Calculated Property
Vc 1.15 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1026.59 J/mol×K 921.07 Joback Calculated Property
η 0.00 Pa×s 921.07 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 3
-CH3 4
=CH- (ring) 4
=C< (ring) 2
-CH2- 3
>C< 1
>C=O (nonring) 2
>CH- (ring) 2
-CH2- (ring) 4

Similar Compounds

Dimethylmalonic acid, 4-(4-methoxyphenyl)cyclohexyl pentyl ester. Dimethylmalonic acid, ethyl 4-(4-methoxyphenyl)cyclohexyl ester. Dimethylmalonic acid, hexyl 4-(4-methoxyphenyl)cyclohexyl ester. Dimethylmalonic acid, 4-(4-methoxyphenyl)cyclohexyl octyl ester. Dimethylmalonic acid, heptyl 4-(4-methoxyphenyl)cyclohexyl ester. Dimethylmalonic acid, 4-(4-methoxyphenyl)cyclohexyl nonyl ester. Dimethylmalonic acid, decyl 4-(4-methoxyphenyl)cyclohexyl ester. Dimethylmalonic acid, isohexyl 4-(4-methoxyphenyl)cyclohexyl ester. Dimethylmalonic acid, monochloride, 4-(4-methoxyphenyl)cyclohexyl ester. Succinic acid, 3-methylbut-2-yl 4-(4-methoxyphenyl)cyclohexyl ester. Succinic acid, 2-methylpent-3-yl 4-(4-methoxyphenyl)cyclohexyl ester. Succinic acid, hept-2-yl 4-(4-methoxyphenyl)cyclohexyl ester. Succinic acid, dec-2-yl 4-(4-methoxyphenyl)cyclohexyl ester. Succinic acid, 2-ethylhexyl 4-(4-methoxyphenyl)cyclohexyl ester. Succinic acid, cyclohexylmethyl 4-(4-methoxyphenyl)cyclohexyl ester.

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