Chemical Properties of (-)-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-/t15-/m0/s1

InChI Key

GAIBLDCXCZKKJE-LVVNOCGRSA-N

Formula

C15H24

SMILES

C=C1/C=C/[C@H](C(C)C)CC/C(C)=C/CC1

Molecular Weight¹

204.36

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• ¹: Molecular weight from the IUPAC atomic weights tables.

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	[1482.00; 1490.00]
Inp	1482.00		NIST
Inp	1490.00		NIST

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
Equation			Y = 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 B			1.22946e+00
Coefficient C			-5.05920e-04
Coefficient D			1.12000e-08
Coefficient E			0.00000e+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
Equation			Y = 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 B			2.34321e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid 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

Find more compounds similar to (-)-Germacrene D.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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.
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