Chemical Properties of trans-«alpha»-(Z)-Bergamotol

trans-«alpha»-(Z)-Bergamotol

InChI
InChI=1S/C15H24O/c1-11(10-16)5-4-8-15(3)13-7-6-12(2)14(15)9-13/h5-6,13-14,16H,4,7-10H2,1-3H3/b11-5-/t13-,14-,15+/m1/s1
InChI Key
JGINTSAQGRHGMG-KAIHXKKWSA-N
Formula
C15H24O
SMILES
CC(=CCCC1(C)C2CC=C(C)C1C2)CO
Molecular Weight1
220.35
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Physical Properties

Property Value Unit Source
ΔfusH° 27.36 kJ/mol Joback Calculated Property
ΔvapH° 94.11 kJ/mol Relay (1.0) Calculated Property
IE 8.10 eV Relay (1.0) Calculated Property
logPoct/wat 3.698 Crippen Calculated Property
McVol 197.760 ml/mol McGowan Calculated Property
Inp 1606.00 NIST
Tboil 577.53 K Relay (1.0) Calculated Property
Tfus 306.29 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, 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 [566.15; 656.88] J/mol×K [656.28; 851.05] Show Hide
Cp,gas 566.15 J/mol×K 656.28 Joback Calculated Property
Cp,gas 582.77 J/mol×K 688.74 Joback Calculated Property
Cp,gas 598.62 J/mol×K 721.20 Joback Calculated Property
Cp,gas 613.83 J/mol×K 753.67 Joback Calculated Property
Cp,gas 628.52 J/mol×K 786.13 Joback Calculated Property
Cp,gas 642.83 J/mol×K 818.59 Joback Calculated Property
Cp,gas 656.88 J/mol×K 851.05 Joback Calculated Property

Similar Compounds

(E)-trans-«alpha»-bergamota-2,10-dien-12-ol. «alpha»-Bergamotol. trans-«alpha»-Bergamotol. Bergamotol, Z-«alpha»-trans-. (Z)-Bergamotol acetate. (E)-trans-Bergamota-2,12-dien-14-ol. (Z)-«alpha»-trans-Bergamotene. Bergamotol. (Z)-trans-Bergamotol. (-)-Myrtenol. Bicyclo[3.1.1]hept-2-ene-2-methanol, 6,6-dimethyl-. Bicyclo[3.1.1]hept-2-ene-2-methanol, 6,6-dimethyl-, (1S)-. Ylangenol. Tricyclo[4.4.0.0(2,7)]dec-3-ene-3-methanol, 1-methyl-8-(1-methylethyl)-. (E)-Sesquithujen-12-ol.

Find more compounds similar to trans-«alpha»-(Z)-Bergamotol.

Sources

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