Chemical Properties of uroterpenol (CAS 6252-35-3)

InChI

InChI=1S/C10H18O2/c1-8-3-5-9(6-4-8)10(2,12)7-11/h3,9,11-12H,4-7H2,1-2H3

InChI Key

ZJALAEQNHJQSTN-UHFFFAOYSA-N

Formula

C10H18O2

SMILES

CC1=CCC(C(C)(O)CO)CC1

Molecular Weight¹

170.25

CAS

6252-35-3

Other Names

• 2-(4-methyl-3-cyclohexen-1-yl)propane-1,2-diol

• 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).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_p : Polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor 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	[199.12; 524.78]	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			-6.36190e+01
Coefficient B			1.15424e+00
Coefficient C			-7.54040e-04
Coefficient D			1.88200e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	199.12	J/mol×K	273.00	Calculated Property
Cp,gas	258.68	J/mol×K	353.78	Calculated Property
Cp,gas	311.01	J/mol×K	434.56	Calculated Property
Cp,gas	356.71	J/mol×K	515.33	Calculated Property
Cp,gas	396.36	J/mol×K	596.11	Calculated Property
Cp,gas	430.56	J/mol×K	676.89	Calculated Property
Cp,gas	459.90	J/mol×K	757.67	Calculated Property
Cp,gas	484.99	J/mol×K	838.44	Calculated Property
Cp,gas	506.42	J/mol×K	919.22	Calculated Property
Cp,gas	524.78	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0135407; 0.0000496]	Pa×s	[347.18; 575.48]	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			-1.84417e+01
Coefficient B			4.90901e+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.			347.18
Temperature range, max.			575.48
η	0.0135407	Pa×s	347.18	Calculated Property
η	0.0051704	Pa×s	372.55	Calculated Property
η	0.0022321	Pa×s	397.91	Calculated Property
η	0.0010657	Pa×s	423.28	Calculated Property
η	0.0005532	Pa×s	448.65	Calculated Property
η	0.0003080	Pa×s	474.01	Calculated Property
η	0.0001820	Pa×s	499.38	Calculated Property
η	0.0001132	Pa×s	524.74	Calculated Property
η	0.0000735	Pa×s	550.11	Calculated Property
η	0.0000496	Pa×s	575.48	Calculated Property

Similar Compounds

Find more compounds similar to uroterpenol.

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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