Chemical Properties of (3S,3aS,6R,8aS)-3,7,7-Trimethyl-8-methyleneoctahydro-1H-3a,6-methanoazulene (CAS 18444-94-5)

(3S,3aS,6R,8aS)-3,7,7-Trimethyl-8-methyleneoctahydro-1H-3a,6-methanoazulene

InChI
InChI=1S/C15H24/c1-10-5-6-13-11(2)14(3,4)12-7-8-15(10,13)9-12/h10,12-13H,2,5-9H2,1,3-4H3
InChI Key
VBZRHXLPRWBPEH-UHFFFAOYSA-N
Formula
C15H24
SMILES
C=C1C2CCC(C)C23CCC(C3)C1(C)C
Molecular Weight1
204.35
CAS
18444-94-5
Other Names
  • Khusimene
  • Zizaene
  • Khusene
  • Ziza-6(13)-ene
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Physical Properties

Property Value Unit Source
ΔfusH° 13.20 kJ/mol Joback Calculated Property
logPoct/wat 4.415 Crippen Calculated Property
McVol 185.330 ml/mol McGowan Calculated Property
Inp [1447.00; 1468.00]   Show Hide
Inp 1449.00 NIST
Inp 1453.00 NIST
Inp 1451.00 NIST
Inp Outlier 1468.00 NIST
Inp 1456.00 NIST
Inp 1457.00 NIST
Inp 1449.00 NIST
Inp 1447.00 NIST
Inp 1463.00 NIST
Inp 1449.00 NIST
Inp 1452.00 NIST
Inp 1453.00 NIST
Inp 1453.00 NIST
I [1597.00; 1620.00]   Show Hide
I 1620.00 NIST
I 1597.00 NIST
I 1597.00 NIST

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Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [501.94; 623.10] J/mol×K [561.66; 785.91] Show Hide
Cp,gas 501.94 J/mol×K 561.66 Joback Calculated Property
Cp,gas 525.20 J/mol×K 599.03 Joback Calculated Property
Cp,gas 546.85 J/mol×K 636.41 Joback Calculated Property
Cp,gas 567.18 J/mol×K 673.78 Joback Calculated Property
Cp,gas 586.48 J/mol×K 711.16 Joback Calculated Property
Cp,gas 605.02 J/mol×K 748.53 Joback Calculated Property
Cp,gas 623.10 J/mol×K 785.91 Joback Calculated Property

Similar Compounds

Khusimene. Zizaene. (3S,3aS,6R,8aS)-3,8,8-Trimethyl-7-methyleneoctahydro-1H-3a,6-methanoazulene. Prezizaene. -Duprezizaenene. 1,4-Methano-1H-indene, octahydro-4-methyl-8-methylene-7-(1-methylethyl)-, [1S-(1«alpha»,3a«beta»,4«alpha»,7«alpha»,7a«beta»)]-. Sativene. Isosativene. Longifolene. Camphene. Bicyclo[2.2.1]heptane, 2,2-dimethyl-3-methylene-, (1r)-. Seychellene. 1H-3a,7-Methanoazulene, octahydro-1,9,9-trimethyl-4-methylene-, (1«alpha»,3a«alpha»,7«alpha»,8a«beta»)-. (-)-Sinularene. (+)-scapanene.

Find more compounds similar to (3S,3aS,6R,8aS)-3,7,7-Trimethyl-8-methyleneoctahydro-1H-3a,6-methanoazulene.

Sources

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Outlier This icon means that the value is more than 2 standard deviations away from the property mean.