Chemical Properties of Germacrene D (CAS 23986-74-5)

Germacrene D

InChI
InChI=1S/C15H24/c1-12(2)15-10-8-13(3)6-5-7-14(4)9-11-15/h7-8,10,12,15H,3,5-6,9,11H2,1-2,4H3/b10-8-,14-7-
InChI Key
GAIBLDCXCZKKJE-BZXLUOIMSA-N
Formula
C15H24
SMILES
C=C1C=CC(C(C)C)CCC(C)=CCC1
Molecular Weight1
204.35
CAS
23986-74-5
Other Names
  • (S,1Z,6Z)-8-Isopropyl-1-methyl-5-methylenecyclodeca-1,6-diene
  • D-Germacrene
  • 1(10),4(14),5-Germacratriene
  • (-)-Germacrene D
  • 1,6-Cyclodecadiene, 1-methyl-5-methylene-8-(1-methylethyl)-, [s-(E,E)]-
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Physical Properties

Property Value Unit Source
ΔfusH° 15.41 kJ/mol Joback Calculated Property
logPoct/wat 4.891 Crippen Calculated Property
McVol 198.450 ml/mol McGowan Calculated Property
Inp [1436.00; 1529.00]   Show Hide
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Inp Outlier 1450.00 NIST
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Inp Outlier 1516.00 NIST
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Inp Outlier 1500.00 NIST
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Ip [1663.00; 1746.00]   Show Hide
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Cheméo can also estimate Normal Boiling Point Temperature, 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 [251.79; 688.37] 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-4.63700e+01
Coefficient B1.22946e+00
Coefficient C-5.05920e-04
Coefficient D1.12000e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 251.79 J/mol×K 273.00 Calculated Property
Cp,gas 325.76 J/mol×K 353.78 Calculated Property
Cp,gas 393.28 J/mol×K 434.56 Calculated Property
Cp,gas 454.39 J/mol×K 515.33 Calculated Property
Cp,gas 509.12 J/mol×K 596.11 Calculated Property
Cp,gas 557.51 J/mol×K 676.89 Calculated Property
Cp,gas 599.59 J/mol×K 757.67 Calculated Property
Cp,gas 635.41 J/mol×K 838.44 Calculated Property
Cp,gas 664.99 J/mol×K 919.22 Calculated Property
Cp,gas 688.37 J/mol×K 1000.00 Calculated Property
Property Value Unit Temperature (K) Source
η [0.0085131; 0.0000783] Pa×s [264.83; 563.35] Joback Predicted correlation Show Hide
EquationY = exp(A + B/T + C·ln(T) + D·T^E)
Y is η in Pa×s, T in K
Coefficient A-1.36141e+01
Coefficient B2.34321e+03
Coefficient C0.00000e+00
Coefficient D0.00000e+00
Coefficient E0.00000e+00
CommentLiquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.264.83
Temperature range, max.563.35
η 0.0085131 Pa×s 264.83 Calculated Property
η 0.0031797 Pa×s 298.00 Calculated Property
η 0.0014466 Pa×s 331.17 Calculated Property
η 0.0007596 Pa×s 364.34 Calculated Property
η 0.0004442 Pa×s 397.50 Calculated Property
η 0.0002821 Pa×s 430.67 Calculated Property
η 0.0001912 Pa×s 463.84 Calculated Property
η 0.0001365 Pa×s 497.01 Calculated Property
η 0.0001016 Pa×s 530.18 Calculated Property
η 0.0000783 Pa×s 563.35 Calculated Property

Similar Compounds

Isogermacrene D. Germacrene D isomer # 1. (-)-Germacrene D. Isocembrene. (6S)-2-Methyl-6-[(1R)-4-methylenecyclohex-2-enyl]hept-2-ene. Cyclohexene, 3-(1,5-dimethyl-4-hexenyl)-6-methylene-, [S-(R*,S*)]-. «beta»-Phellandrene. «delta»-phellandrene. Isogermacrene D. 1,3,6,10-Cyclotetradecatetraene, 3,7,11-trimethyl-14-(1-methylethyl)-, [S-(E,Z,E,E)]-. Cembrene C. 3(Z)-Cembrene A. 2,10,14-trimethyl-6-methylene-7(3-methyl-pent-4-enyl)-pentadec-2,9,13-triene. «beta»-Cuprenene. (R)-3-Methylene-6-((S)-1,2,2-trimethylcyclopentyl)cyclohex-1-ene.

Find more compounds similar to Germacrene D.

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.
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