Chemical Properties of Hexahydrogermacrone-c

Hexahydrogermacrone-c

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InChI
InChI=1S/C15H28O/c1-11(2)14-9-8-12(3)6-5-7-13(4)10-15(14)16/h11-14H,5-10H2,1-4H3
InChI Key
IVZVLIBJTFLRJR-UHFFFAOYSA-N
Formula
C15H28O
SMILES
CC(C)C1CCC(C)CCCC(C)CC1=O
Molecular Weight1
224.38
Sources

Physical Properties

Property Value Unit Source
Δf -88.98 kJ/mol Joback Calculated Property
Δfgas -506.91 kJ/mol Joback Calculated Property
Δfus 16.17 kJ/mol Joback Calculated Property
Δvap 53.34 kJ/mol Joback Calculated Property
logPoct/wat 4.45 Crippen Calculated Property
Pc 1771.36 kPa Joback Calculated Property
Tboil 637.27 K Joback Calculated Property
Tc 866.15 K Joback Calculated Property
Tfus 296.85 K Joback Calculated Property
Vc 0.78 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 610.85 J/mol×K 637.27 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-CH3 4
>CH- (ring) 3
-CH2- (ring) 6
>C=O (ring) 1

Similar Compounds

Hexahydrogermacrone-b. Hexahydrogermacrone-a. (1R,4S)-(-)-menthone. (1R,4R)-(+)-isomenthone. Bisabol-1-one. Cyclohexanone, 5-methyl-2-(1-methylethyl)-, trans-. Cyclohexanone, 5-methyl-2-(1-methylethyl)-, (2R-cis)-. Cyclohexanone, 5-methyl-2-(1-methylethyl)-, (2S-cis)-. Cyclohexanone, 5-methyl-2-(1-methylethyl)-. Cyclohexanone, 5-methyl-2-(1-methylethyl)-, cis-. 2-ethyl isomenthone. 1(2H)-Naphthalenone, octahydro-, trans-. 1-Decalone (cis-trans). Cyclohexanone, 2-ethyl-3-methyl-, trans-. 2-hexylcyclohexan-1-one.

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