Chemical Properties of Kaur-15-ene, (5«alpha»,9«alpha»,10«beta»)- (CAS 511-85-3)

Kaur-15-ene, (5«alpha»,9«alpha»,10«beta»)-

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InChI
InChI=1S/C20H32/c1-14-12-20-11-8-16-18(2,3)9-5-10-19(16,4)17(20)7-6-15(14)13-20/h12,15-17H,5-11,13H2,1-4H3/t15?,16-,17+,19-,20?/m1/s1
InChI Key
DQUHDYWUEKWRLN-VYCOEXPQSA-N
Formula
C20H32
SMILES
CC1=CC23CC1CCC2C1(C)CCCC(C)(C)C1CC3
Molecular Weight1
272.47
CAS
511-85-3
Other Names
  • (+)-Isophyllocladene
  • Isophyllocladen
  • Isophyllocladene
  • Isophyllocladene, (+)-
  • Phylloclad-15-ene
Sources

Physical Properties

Property Value Unit Source
Δf 300.56 kJ/mol Joback Calculated Property
Δfgas -138.22 kJ/mol Joback Calculated Property
Δfus 15.78 kJ/mol Joback Calculated Property
Δvap 57.34 kJ/mol Joback Calculated Property
logPoct/wat 5.98 Crippen Calculated Property
Pc 1696.30 kPa Joback Calculated Property
Tboil 696.56 K Joback Calculated Property
Tc 939.38 K Joback Calculated Property
Tfus 449.34 K Joback Calculated Property
Vc 0.93 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 769.83 J/mol×K 696.56 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
=CH- (ring) 1
=C< (ring) 1
>C< (ring) 3
-CH3 4
>CH- (ring) 3
-CH2- (ring) 8

Similar Compounds

«alpha»-Kaurene. (5,9«alpha»-, 10«beta»)-Kaur-15-ene. Kaur-15-ene. Cyclobazzanene. Silphiperfol-5-ene, B. Silphiperfol-5-ene. 7- «alpha»-[H]-Silphiperfol-5-ene. 7-epi-Silphiperfol-5-ene. Silphiperfol-5-ene, A. 7-epi-Silphiperfol-5-ene. 7«alpha»-H-Silfiperfol-5-ene. 7«alpha»-silphiperfol-5-ene. Silphiperfol-5-ene. 7«beta»-H-Silfiperfol-5-ene. 1,4,6-Trimethyl-1,2,3,3a,4,7,8,8a-octahydro-4,7-ethanoazulene.

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