Chemical Properties of 1,3,3-Trimethylcyclohex-1-ene-4-carboxylic acid (CAS 13746-43-5)

1,3,3-Trimethylcyclohex-1-ene-4-carboxylic acid

InChI
InChI=1S/C10H16O2/c1-7-4-5-8(9(11)12)10(2,3)6-7/h6,8H,4-5H2,1-3H3,(H,11,12)
InChI Key
LMQGITVNFNTYPJ-UHFFFAOYSA-N
Formula
C10H16O2
SMILES
CC1=CC(C)(C)C(C(=O)O)CC1
Molecular Weight1
168.23
CAS
13746-43-5
Other Names
  • 2,2,4-Trimethylcyclohex-3-ene-1-carboxylic acid
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
ΔfusH° 19.24 kJ/mol Joback Calculated Property
logPoct/wat 2.454 Crippen Calculated Property
McVol 144.040 ml/mol McGowan Calculated Property
Inp 1301.70 NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [373.51; 454.14] J/mol×K [593.17; 817.62] Show Hide
Cp,gas 373.51 J/mol×K 593.17 Joback Calculated Property
Cp,gas 388.81 J/mol×K 630.58 Joback Calculated Property
Cp,gas 403.20 J/mol×K 667.99 Joback Calculated Property
Cp,gas 416.81 J/mol×K 705.40 Joback Calculated Property
Cp,gas 429.75 J/mol×K 742.81 Joback Calculated Property
Cp,gas 442.15 J/mol×K 780.21 Joback Calculated Property
Cp,gas 454.14 J/mol×K 817.62 Joback Calculated Property

Similar Compounds

(3S,3aS,6R)-7,7,8-Trimethyl-2,3,4,5,6,7-hexahydro-1H-3a,6-methanoazulene-3-carboxylic acid. Dihydroartemisinic acid. 1,3,3-Trimethylcyclohex-1-ene-4-carboxaldehyde, (+,-)-. [14C] GA15-15,16-ene methyl ester. GA1 1,10-ene diacid, MeTMS. Bicyclo[2.2.1]-5-heptene-2-carboxylic acid. Exo-bicyclo(2.2.1)hept-5-ene-2-carboxylic acid. 1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydro-1,4a-dimethyl-7-(1-methylethylidene)-, [1R-(1«alpha»,4a«beta»,4b«alpha»,10a«alpha»)]-. 4-Cyclohexene-1,2-dicarboxylic acid, 4-methyl-, dimethyl ester. 3-Cyclohexene-1-carboxylic acid, 4-methyl-, methyl ester. 1-Naphthalenepentanoic acid, 1,4,4a,5,6,7,8,8a-octahydro-«beta»,2,5,5,8a-pentamethyl-. Khusimyl acid. (3S,3aR,6R,8aS)-7,7-Dimethyl-8-methyleneoctahydro-1H-3a,6-methanoazulene-3-carboxylic acid. (1S,4aR,5S,8aR)-1,4a-Dimethyl-6-methylene-5-((E)-3-methylpenta-2,4-dien-1-yl)decahydronaphthalene-1-carboxylic acid. cis-3-Methyl-4-cyclohexene-1,2-dicarboxylic acid.

Find more compounds similar to 1,3,3-Trimethylcyclohex-1-ene-4-carboxylic acid.

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
These property values are available through the Cheméo API. A free account gives you an access key.