Chemical Properties of 1H-Cycloprop[e]azulen-7-ol, decahydro-1,1,7-trimethyl-4-methylene-, [1ar-(1a«alpha»,4a«alpha»,7«beta»,7a«beta»,7b«alpha»)]- (CAS 6750-60-3)

1H-Cycloprop[e]azulen-7-ol, decahydro-1,1,7-trimethyl-4-methylene-, [1ar-(1a«alpha»,4a«alpha»,7«beta»,7a«beta»,7b«alpha»)]-

InChI
InChI=1S/C15H24O/c1-9-5-6-11-13(14(11,2)3)12-10(9)7-8-15(12,4)16/h10-13,16H,1,5-8H2,2-4H3/t10?,11?,12?,13?,15-/m1/s1
InChI Key
FRMCCTDTYSRUBE-OUZJWQAESA-N
Formula
C15H24O
SMILES
C=C1CCC2C(C3C1CCC3(C)O)C2(C)C
Molecular Weight1
220.35
CAS
6750-60-3
Other Names
  • (1aR,4aR,7S,7aR,7bR)-1,1,7-Trimethyl-4-methylenedecahydro-1H-cyclopropa[e]azulen-7-ol
  • Spathulenol
  • 1,1,7-Trimethyl-4-methylenedecahydro-1H-cyclopropa[e]azulen-7-ol-, (1aR-(1a«alpha»,4a«alpha»,7«beta»,7a«beta»,7b«alpha»))-
  • (+)-Spathulenol
  • Espatulenol
  • Spatulenol
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Physical Properties

Property Value Unit Source
ΔfusH° 18.36 kJ/mol Joback Calculated Property
logPoct/wat 3.386 Crippen Calculated Property
McVol 191.200 ml/mol McGowan Calculated Property
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Tboil 556.73 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [251.52; 757.36] 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-2.26300e+02
Coefficient B2.28316e+00
Coefficient C-2.19700e-03
Coefficient D8.97500e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 251.52 J/mol×K 273.00 Calculated Property
Cp,gas 346.20 J/mol×K 353.78 Calculated Property
Cp,gas 424.63 J/mol×K 434.56 Calculated Property
Cp,gas 489.66 J/mol×K 515.33 Calculated Property
Cp,gas 544.13 J/mol×K 596.11 Calculated Property
Cp,gas 590.87 J/mol×K 676.89 Calculated Property
Cp,gas 632.73 J/mol×K 757.67 Calculated Property
Cp,gas 672.54 J/mol×K 838.44 Calculated Property
Cp,gas 713.13 J/mol×K 919.22 Calculated Property
Cp,gas 757.36 J/mol×K 1000.00 Calculated Property

Similar Compounds

(-)-Spathulenol. (+)-spatulenol. Isospathulenol. Spathylenol. 4(15)-Dehydroglobulol. 1-endo-Bourbonanol. Cyclopentanol, 1,2-dimethyl-3-(1-methylethenyl)-, [1R-(1«alpha»,2«alpha»,3«alpha»)]-. 1,2-dimethyl-3-(1-methylethenyl) cyclopentanol. Cyclopentanol, 1,2-dimethyl-3-(1-methylethenyl)-, [1R-(1«alpha»,2«beta»,3«beta»)]-. (+)-aromadendra-4(15),10(14)-dien-1-ol. (-)-(4R,5R,6S,10S)-gorgon-11-en-4-ol. .beta.-Cubeb-6-ol. 1-epi-3,4-Dehydroviridiflorol. 3,4-Dehydroglobulol. Isospathulenol.

Find more compounds similar to 1H-Cycloprop[e]azulen-7-ol, decahydro-1,1,7-trimethyl-4-methylene-, [1ar-(1a«alpha»,4a«alpha»,7«beta»,7a«beta»,7b«alpha»)]-.

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
Outlier This icon means that the value is more than 2 standard deviations away from the property mean.
Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
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