Chemical Properties of Aristol-9-en-3-ol

Aristol-9-en-3-ol

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InChI
InChI=1S/C15H24O/c1-9-12(16)8-6-10-5-7-11-13(14(11,2)3)15(9,10)4/h5,9,11-13,16H,6-8H2,1-4H3/t9-,11-,12?,13+,15+/m0/s1
InChI Key
FILZQHSQXIHNEM-JLPMGGNJSA-N
Formula
C15H24O
SMILES
CC1C(O)CCC2=CCC3C(C3(C)C)C21C
Molecular Weight1
220.35
Sources

Physical Properties

Property Value Unit Source
Δf 82.87 kJ/mol Joback Calculated Property
Δfgas -283.31 kJ/mol Joback Calculated Property
Δfus 20.35 kJ/mol Joback Calculated Property
Δvap 63.47 kJ/mol Joback Calculated Property
logPoct/wat 3.39 Crippen Calculated Property
Pc 2237.64 kPa Joback Calculated Property
Tboil 654.15 K Joback Calculated Property
Tc 862.88 K Joback Calculated Property
Tfus 414.77 K Joback Calculated Property
Vc 0.73 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 576.39 J/mol×K 654.15 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
=CH- (ring) 1
-OH (alcohol) 1
=C< (ring) 1
>C< (ring) 2
-CH3 4
>CH- (ring) 4
-CH2- (ring) 3

Similar Compounds

9-Aristolen-«alpha»-ol. 9-Aristolen-1-ol. urs-12-ene-3«beta»,28-diol. 1-epi-3,4-Dehydroviridiflorol. 3,4-Dehydroglobulol. cis-«alpha»-Copaen-8-ol. «alpha»-Copaen-8«alpha»-ol. «alpha»-Copaen-8-ol. .BETA.-amyrin. .ALPHA.-amyrin. 7-Dehydro DHEA. 5.beta.-Pregn-8-ene-3.alpha.,20.alpha.-diol. 4,4,14-.alpha.-Trimethyl-5-.alpha.-cholest-7-en-3-.beta.-ol. 4,4,14-.alpha.-Trimethyl-5-.alpha.-cholest-9(11)-en-3-.beta.-ol. 5-Pregnene-3«beta»,20«alpha»,21-triol.

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