Chemical Properties of Bicyclo[9.3.1]pentadeca-3,7-dien-12-ol, 4,8,12,15,15-pentamethyl-, [1R-(1R*,3E,7E,11R*,12R*)]- (CAS 70000-19-0)

Bicyclo[9.3.1]pentadeca-3,7-dien-12-ol, 4,8,12,15,15-pentamethyl-, [1R-(1R*,3E,7E,11R*,12R*)]-

InChI
InChI=1S/C20H34O/c1-15-7-6-8-16(2)10-12-18-19(3,4)17(11-9-15)13-14-20(18,5)21/h8-9,17-18,21H,6-7,10-14H2,1-5H3/b15-9-,16-8-
InChI Key
CQWSCMMFUZYKBO-KUONJXJVSA-N
Formula
C20H34O
SMILES
CC1=CCC2CCC(C)(O)C(CCC(C)=CCC1)C2(C)C
Molecular Weight1
290.48
CAS
70000-19-0
Other Names
  • Verticiol
  • Verticillol
  • 4,8,12,15,15-Pentamethylbicyclo[9.3.1]pentadeca-3,7-dien-12-ol l-, (1R,3E,7E,11R,12R)-
  • Bicyclo[9.3.1]pentadeca-3,7-dien-12-ol, 4,8,12,15,15-pentamethyl-, (1R,3E,7E,11R,12R)-
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Physical Properties

Property Value Unit Source
ΔfusH° 20.23 kJ/mol Joback Calculated Property
logPoct/wat 5.647 Crippen Calculated Property
McVol 268.210 ml/mol McGowan Calculated Property
Inp [2036.70; 2106.00]   Show Hide
Inp 2036.70 NIST
Inp 2106.00 NIST
Inp 2106.00 NIST
Inp 2106.00 NIST
Inp 2036.70 NIST

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [340.17; 1004.60] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-2.00520e+02
Coefficient B2.45310e+00
Coefficient C-1.91228e-03
Coefficient D6.64300e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 340.17 J/mol×K 273.00 Calculated Property
Cp,gas 457.41 J/mol×K 353.78 Calculated Property
Cp,gas 558.89 J/mol×K 434.56 Calculated Property
Cp,gas 646.72 J/mol×K 515.33 Calculated Property
Cp,gas 722.99 J/mol×K 596.11 Calculated Property
Cp,gas 789.81 J/mol×K 676.89 Calculated Property
Cp,gas 849.29 J/mol×K 757.67 Calculated Property
Cp,gas 903.51 J/mol×K 838.44 Calculated Property
Cp,gas 954.58 J/mol×K 919.22 Calculated Property
Cp,gas 1004.60 J/mol×K 1000.00 Calculated Property

Similar Compounds

.beta.-Acorenol. Acorenol isomer. «beta»-epi-Acorenol. «beta»-Acorenol. «beta»-acorenal. «alpha»-Acorenol. «alpha»-acorenal. 10-epi-«beta»-Acorenol. trans-Dauc-8-en-4.beta.-ol. 3 «alpha»-Hydroxy-6-asteriscene. Hedycariol. 3,7-Cyclodecadiene-1-methanol, «alpha»,«alpha»,4,8-tetramethyl-, [s-(Z,Z)]. Cadin-3-en-10-«beta»-ol. Cadin-3-en-10-«alpha»-ol. «gamma»-Cadinol.

Find more compounds similar to Bicyclo[9.3.1]pentadeca-3,7-dien-12-ol, 4,8,12,15,15-pentamethyl-, [1R-(1R*,3E,7E,11R*,12R*)]-.

Sources

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