Chemical Properties of Butanoic acid, 2,2-diethyl-3,3-dimethyl, ethyl ester

Butanoic acid, 2,2-diethyl-3,3-dimethyl, ethyl ester

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InChI
InChI=1S/C12H24O2/c1-7-12(8-2,11(4,5)6)10(13)14-9-3/h7-9H2,1-6H3
InChI Key
PDIVLKNUSLZXIC-UHFFFAOYSA-N
Formula
C12H24O2
SMILES
CCOC(=O)C(CC)(CC)C(C)(C)C
Molecular Weight1
200.32
Sources

Physical Properties

Property Value Unit Source
Δf -178.08 kJ/mol Joback Calculated Property
Δfgas -553.31 kJ/mol Joback Calculated Property
Δfus 14.79 kJ/mol Joback Calculated Property
Δvap 48.87 kJ/mol Joback Calculated Property
logPoct/wat 3.40 Crippen Calculated Property
Pc 1913.58 kPa Joback Calculated Property
Tboil 543.79 K Joback Calculated Property
Tc 732.60 K Joback Calculated Property
Tfus 302.00 K Joback Calculated Property
Vc 0.71 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 469.94 J/mol×K 543.79 Joback Calculated Property
η 0.00 Pa×s 543.79 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-CH2- 3
>C=O (nonring) 1
>C< 2
-CH3 6

Similar Compounds

Butanoic acid, 2-ethyl-2,3,3-trimethyl, ethyl ester. Butanoic acid, 2-isopropyl-2,3,3-trimethyl, ethyl ester. Butanoic acid, 2-ethyl-3,3-dimethyl, ethyl ester. Butanoic acid, 2,2,3,3-tetramethyl, ethyl ester. Butanoic acid, 2-tert.-butyl-3,3-dimethyl, ethyl ester. Butanoic acid, 3,3-dimethyl-2-(1-methylethyl), ethyl ester. Butanoic acid, 2,2,3-trimethyl, ethyl ester. Butanoic acid, 2,2-diethyl, ethyl ester. Butanoic acid, 2-ethyl-3-methyl, ethyl ester. Butanoic acid, 2,3,3-trimethyl, ethyl ester. Butanoic acid, 2-isopropyl-3-methyl, ethyl ester. Triethylsuccinic anhydride. cis-1-carbomethoxy-1,2-dimethylcyclohexane. trans-carbomethoxy-1,2-dimethylcyclohexane. Bicyclo[3.3.0]octane-1-carboxylic acid, methyl ester.

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