Chemical Properties of 3-ethyladamantane-1-carboxylic acid, methyl ester

3-ethyladamantane-1-carboxylic acid, methyl ester

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InChI
InChI=1S/C14H22O2/c1-3-13-5-10-4-11(6-13)8-14(7-10,9-13)12(15)16-2/h10-11H,3-9H2,1-2H3
InChI Key
ZWAHRPCXTAHOBO-UHFFFAOYSA-N
Formula
C14H22O2
SMILES
CCC12CC3CC(C1)CC(C(=O)OC)(C3)C2
Molecular Weight1
222.32
Sources

Physical Properties

Property Value Unit Source
Δf -15.46 kJ/mol Joback Calculated Property
Δfgas -354.71 kJ/mol Joback Calculated Property
Δfus 15.58 kJ/mol Joback Calculated Property
Δvap 53.21 kJ/mol Joback Calculated Property
logPoct/wat 3.16 Crippen Calculated Property
Pc 2393.53 kPa Joback Calculated Property
Tboil 616.31 K Joback Calculated Property
Tc 839.69 K Joback Calculated Property
Tfus 413.56 K Joback Calculated Property
Vc 0.70 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 524.80 J/mol×K 616.31 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

3,5-dimethyladamantane-1-carboxylic acid, methyl ester. 1-Adamantanecarboxylic acid, methyl ester. cis-1-carbomethoxy-1,3-dimethylcyclohexane. trans-carbomethoxy-1,3-dimethylcyclohexane. 5,7-dimethyladamantane-1,3-dicarboxylic acid, dimethyl ester. 4a-methyladamantane-1e-carboxylic acid, methyl ester. 4e-methyladamantane-1e-carboxylic acid, methyl ester. Ethyladamantane-1-carboxylate. Cyclohexanecarboxylic acid, 1-propyl-, methyl ester. Cyclohexanecarboxylic acid, 1-ethyl-, methyl ester. Cyclohexanecarboxylic acid, 1-butyl-, methyl ester. Bicyclo[2.2.1]heptan-1-carboxylic acid, methyl ester. Adamantane-1-carboxylic acid, propyl ester. Adamantane-1-carboxylic acid, butyl ester. Adamantane-1-carboxylic acid, isobutyl ester.

Find more compounds similar to 3-ethyladamantane-1-carboxylic acid, methyl ester.

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