Chemical Properties of Cadina-1(10),4-dien-8.alpha.-ol

InChI

InChI=1S/C15H24O/c1-9(2)15-13-7-10(3)5-6-12(13)11(4)8-14(15)16/h7,9,13-16H,5-6,8H2,1-4H3/t13?,14-,15?/m1/s1

InChI Key

VAVHKURKIQXFJX-SLTAFYQDSA-N

Formula

C15H24O

SMILES

CC1=CC2C(=C(C)C[C@@H](O)C2C(C)C)CC1

Molecular Weight¹

220.36

• 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.
• I_p : Polar retention indices.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	25.39	kJ/mol	Joback Calculated Property
logPoct/wat	3.696		Crippen Calculated Property
McVol	197.760	ml/mol	McGowan Calculated Property
Inp	[1678.00; 1680.00]
Inp	1680.00		NIST
Inp	1678.00		NIST
Ip	2302.00		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	[266.39; 713.93]	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			-6.37100e+01
Coefficient B			1.41518e+00
Coefficient C			-7.98640e-04
Coefficient D			1.61100e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	266.39	J/mol×K	273.00	Calculated Property
Cp,gas	344.13	J/mol×K	353.78	Calculated Property
Cp,gas	413.67	J/mol×K	434.56	Calculated Property
Cp,gas	475.53	J/mol×K	515.33	Calculated Property
Cp,gas	530.22	J/mol×K	596.11	Calculated Property
Cp,gas	578.25	J/mol×K	676.89	Calculated Property
Cp,gas	620.13	J/mol×K	757.67	Calculated Property
Cp,gas	656.36	J/mol×K	838.44	Calculated Property
Cp,gas	687.46	J/mol×K	919.22	Calculated Property
Cp,gas	713.93	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0034789; 0.0001600]	Pa×s	[361.27; 612.98]	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			-1.31598e+01
Coefficient B			2.70906e+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.			361.27
Temperature range, max.			612.98
η	0.0034789	Pa×s	361.27	Calculated Property
η	0.0020297	Pa×s	389.24	Calculated Property
η	0.0012730	Pa×s	417.21	Calculated Property
η	0.0008465	Pa×s	445.17	Calculated Property
η	0.0005908	Pa×s	473.14	Calculated Property
η	0.0004292	Pa×s	501.11	Calculated Property
η	0.0003225	Pa×s	529.08	Calculated Property
η	0.0002494	Pa×s	557.05	Calculated Property
η	0.0001977	Pa×s	585.01	Calculated Property
η	0.0001600	Pa×s	612.98	Calculated Property

Similar Compounds

Find more compounds similar to Cadina-1(10),4-dien-8.alpha.-ol.

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

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Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
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