Chemical Properties of endo-Bicyclo[2.2.1]heptan-2-carboxylic acid, 7,7-dimethyl, methyl ester

endo-Bicyclo[2.2.1]heptan-2-carboxylic acid, 7,7-dimethyl, methyl ester

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InChI
InChI=1S/C11H18O2/c1-11(2)7-4-5-9(11)8(6-7)10(12)13-3/h7-9H,4-6H2,1-3H3/t7-,8+,9+/m1/s1
InChI Key
YOEDQIUFJQMKBL-VGMNWLOBSA-N
Formula
C11H18O2
SMILES
COC(=O)C1CC2CCC1C2(C)C
Molecular Weight1
182.26
Sources

Physical Properties

Property Value Unit Source
Δf -103.69 kJ/mol Joback Calculated Property
Δfgas -401.17 kJ/mol Joback Calculated Property
Δfus 17.05 kJ/mol Joback Calculated Property
Δvap 47.47 kJ/mol Joback Calculated Property
logPoct/wat 2.23 Crippen Calculated Property
Pc 2592.49 kPa Joback Calculated Property
Tboil 536.02 K Joback Calculated Property
Tc 746.72 K Joback Calculated Property
Tfus 333.67 K Joback Calculated Property
Vc 0.58 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 389.61 J/mol×K 536.02 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

exo-Bicyclo[2.2.1]heptan-2-carboxylic acid, 7,7-dimethyl, methyl ester. endo-Bicyclo[2.2.1]heptan-2-carboxylic acid, 7,7-cyclopropano, methyl ester. exo-Bicyclo[2.2.1]heptan-2-carboxylic acid, 7,7-cyclopropano-, methyl ester. 22R-epi-17«beta»(H),21«beta»(H)-Hopanoic acid methyl ester. 22S-epi-17«beta»(H),21«beta»(H)-Hopanoic acid methyl ester. 22R-epi-28-Norhopanoic acid methyl ester. 22S-epi-28-Norhopanoic acid methyl ester. exo-Bicyclo[2.2.1]heptan-2-carboxylic acid, 2,7,7-trimethyl, methyl ester. endo-Bicyclo[2.2.1]heptan-2-carboxylic acid, 2,7,7-trimethyl, methyl ester. endo-Bicyclo[2.2.1]heptan-2-carboxylic acid, methyl ester. Bicyclo[2.2.1]heptane-2-carboxylic acid, methyl ester. exo-Bicyclo[2.2.1]heptan-2-carboxylic acid, 2-methyl, methyl ester. endo-Bicyclo[2.2.1]heptan-2-carboxylic acid, 2-methyl, methyl ester. exo-Bicyclo[2.2.1]heptan-2-carboxylic acid, 7,7-cyclopropano-2-methyl, methyl ester. endo-Bicyclo[2.2.1]heptan-2-carboxylic acid, 7,7-cyclopropano-2-methyl, methyl ester.

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