Chemical Properties of 6,6-dimethylbicyclo[3.1.1]hept-2-ene-2-carboxylic acid (CAS 19250-17-0)

6,6-dimethylbicyclo[3.1.1]hept-2-ene-2-carboxylic acid

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InChI
InChI=1S/C10H14O2/c1-10(2)6-3-4-7(9(11)12)8(10)5-6/h4,6,8H,3,5H2,1-2H3,(H,11,12)
InChI Key
XPHVDOXZJRTIMV-UHFFFAOYSA-N
Formula
C10H14O2
SMILES
CC1(C)C2CC1C(C(=O)O)=CC2
Molecular Weight1
166.22
CAS
19250-17-0
Other Names
  • Myrtenoic acid
Sources

Physical Properties

Property Value Unit Source
Δf -115.89 kJ/mol Joback Calculated Property
Δfgas -333.89 kJ/mol Joback Calculated Property
Δfus 17.12 kJ/mol Joback Calculated Property
Δvap 60.77 kJ/mol Joback Calculated Property
logPoct/wat 2.06 Crippen Calculated Property
Pc 3439.94 kPa Joback Calculated Property
Tboil 591.71 K Joback Calculated Property
Tc 796.05 K Joback Calculated Property
Tfus 378.51 K Joback Calculated Property
Vc 0.51 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 354.13 J/mol×K 591.71 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

Methylmyrtenate. Cedren-15-oic acid. Selina-3,11-dien-14-oic acid. Selina-3,11-dien-14-oic acid. (1R)-(-)-Myrtenal. Bicyclo[3.1.1]hept-2-ene-2-carboxaldehyde, 6,6-dimethyl-. Bicyclo[3.1.1]hept-2-ene-2-carboxaldehyde, 6,6-dimethyl-, (1S)-. (-)-Myrtenol. Bicyclo[3.1.1]hept-2-ene-2-methanol, 6,6-dimethyl-, (1S)-. Bicyclo[3.1.1]hept-2-ene-2-methanol, 6,6-dimethyl-. Ylangenal. Tricyclo[4.4.0.0(2,7)]dec-3-ene-3-methanol, 1-methyl-8-(1-methylethyl)-. Ylangenol. 2-Pinen-10-hydroxyperoxide. Myrtenyl methyl ether.

Find more compounds similar to 6,6-dimethylbicyclo[3.1.1]hept-2-ene-2-carboxylic acid.

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