Chemical Properties of 1,3-Dimethylcyclopentanol

1,3-Dimethylcyclopentanol

InChI
InChI=1S/C7H14O/c1-6-3-4-7(2,8)5-6/h6,8H,3-5H2,1-2H3
InChI Key
LLIFEWZQIYEVKX-UHFFFAOYSA-N
Formula
C7H14O
SMILES
CC1CCC(C)(O)C1
Molecular Weight1
114.19
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
ΔfH°gas -304.09 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 6.68 kJ/mol Joback Calculated Property
ΔvapH° 54.29 kJ/mol Relay (1.0) Calculated Property
IE 9.57 eV Relay (1.0) Calculated Property
log10WS -1.12 Relay (1.0) Calculated Property
logPoct/wat 1.557 Crippen Calculated Property
McVol 104.500 ml/mol McGowan Calculated Property
Tboil 418.65 K Relay (1.0) Calculated Property
Tfus 254.55 ± 0.40 K NIST

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor 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 [232.55; 302.32] J/mol×K [462.59; 655.80] Show Hide
Cp,gas 232.55 J/mol×K 462.59 Joback Calculated Property
Cp,gas 246.05 J/mol×K 494.79 Joback Calculated Property
Cp,gas 258.70 J/mol×K 526.99 Joback Calculated Property
Cp,gas 270.57 J/mol×K 559.19 Joback Calculated Property
Cp,gas 281.74 J/mol×K 591.40 Joback Calculated Property
Cp,gas 292.30 J/mol×K 623.60 Joback Calculated Property
Cp,gas 302.32 J/mol×K 655.80 Joback Calculated Property

Similar Compounds

Bicyclo[2.2.1]heptan-1-ol. 3,5-Dimethyl-3-heptanol. 4-Octanol, 2,4-dimethyl-. 4-Heptanol, 2,4-dimethyl-. 4-Octanol, 4,7-dimethyl-. 1-Cyclohexyl-2-methyl-2-propanol. 3-Hexanol, 3,5-dimethyl-. 3-Hexanol, 3,5-dimethyl-, (.+/-.)-. 3-Heptanol, 3,6-dimethyl-. 3-Dodecanol, 3,7,11-trimethyl-. 3-Hexadecanol, 3,7,11,15-tetramethyl-. 3-Octanol, 3,7-dimethyl-. 3-Octanol, 3,7-dimethyl-. 2-Hexanol, 2,5-dimethyl-, (S)-. Cyclopentanol, 1-methyl-.

Find more compounds similar to 1,3-Dimethylcyclopentanol.

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.