Chemical Properties of Dimethylmalonic acid, monochloride, octyl ester

Dimethylmalonic acid, monochloride, octyl ester

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InChI
InChI=1S/C13H23ClO3/c1-4-5-6-7-8-9-10-17-12(16)13(2,3)11(14)15/h4-10H2,1-3H3
InChI Key
CNMCEFNYJFNGNI-UHFFFAOYSA-N
Formula
C13H23ClO3
SMILES
CCCCCCCCOC(=O)C(C)(C)C(=O)Cl
Molecular Weight1
262.77
Sources

Physical Properties

Property Value Unit Source
Δf -313.35 kJ/mol Joback Calculated Property
Δfgas -693.52 kJ/mol Joback Calculated Property
Δfus 30.59 kJ/mol Joback Calculated Property
Δvap 63.52 kJ/mol Joback Calculated Property
logPoct/wat 3.68 Crippen Calculated Property
Pc 1772.85 kPa Joback Calculated Property
Tboil 661.20 K Joback Calculated Property
Tc 850.26 K Joback Calculated Property
Tfus 390.70 K Joback Calculated Property
Vc 0.83 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 573.58 J/mol×K 661.2 Joback Calculated Property
η 0.00 Pa×s 661.2 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-Cl 1
>C=O (nonring) 2
-CH2- 7
>C< 1
-CH3 3

Similar Compounds

Dimethylmalonic acid, monochloride, nonyl ester. Dimethylmalonic acid, monochloride, decyl ester. Dimethylmalonic acid, monochloride, tetradecyl ester. Dimethylmalonic acid, monochloride, heptyl ester. Dimethylmalonic acid, monochloride, hexyl ester. Dimethylmalonic acid, monochloride, isohexyl ester. Dimethylmalonic acid, monochloride, 3-methylbutyl ester. Dimethylmalonic acid, monochloride, isobutyl ester. Dimethylmalonic acid, monochloride, 2-ethylhexyl ester. Dimethylmalonic acid, monochloride, neopentyl ester. Dimethylmalonic acid, monochloride, 2-octyl ester. Dimethylmalonic acid, monochloride, 4-octyl ester. Dimethylmalonic acid, monochloride, 2-methylpent-3-yl ester. Diethylmalonic acid, monochloride, heptyl ester. Diethylmalonic acid, monochloride, octadecyl ester.

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