Chemical Properties of Cyclohexanemethanol, «alpha»,«alpha»,4-trimethyl-, cis- (CAS 7322-63-6)

InChI

InChI=1S/C10H20O/c1-8-4-6-9(7-5-8)10(2,3)11/h8-9,11H,4-7H2,1-3H3/t8-,9+

InChI Key

UODXCYZDMHPIJE-DTORHVGOSA-N

Formula

C10H20O

SMILES

CC1CCC(C(C)(C)O)CC1

Molecular Weight¹

156.27

CAS

7322-63-6

Other Names

• cis-Dihydro-«alpha»-terpineol
• 2-(4-Methylcyclohexyl)-2-propanol, (Z)-
• cis-p-Menthan-8-ol
• cis-«alpha»,«alpha»,4-trimethylcyclohexanemethanol

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• 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).
• P_c : Critical Pressure (kPa).
• I_np : Non-polar retention indices.
• I : Polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ω	0.5331		Relay (1.0) Calculated Property
ΔfG°	-83.92	kJ/mol	Joback Calculated Property
ΔfH°gas	-356.12	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	11.24	kJ/mol	Joback Calculated Property
ΔvapH°	68.44	kJ/mol	Relay (1.0) Calculated Property
IE	9.28	eV	Relay (1.0) Calculated Property
log10WS	-2.41		Relay (1.0) Calculated Property
logPoct/wat	2.584		Crippen Calculated Property
McVol	146.770	ml/mol	McGowan Calculated Property
Pc	2784.72	kPa	Joback Calculated Property
Inp	[1134.00; 1152.00]
Inp	1152.00		NIST
Inp	1134.00		NIST
Inp	1134.00		NIST
Inp	1152.00		NIST
Inp	1134.00		NIST
I	1571.00		NIST
Tboil	474.80	K	Relay (1.0) Calculated Property
Tc	688.89	K	Relay (1.0) Calculated Property
Tfus	302.57	K	Relay (1.0) Calculated Property
Vc	0.511	m3/kmol	Relay (1.0) Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[192.81; 547.11]	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			-8.50500e+01
Coefficient B			1.20926e+00
Coefficient C			-7.48000e-04
Coefficient D			1.70900e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	192.81	J/mol×K	273.00	Calculated Property
Cp,gas	256.71	J/mol×K	353.78	Calculated Property
Cp,gas	313.21	J/mol×K	434.56	Calculated Property
Cp,gas	362.87	J/mol×K	515.33	Calculated Property
Cp,gas	406.20	J/mol×K	596.11	Calculated Property
Cp,gas	443.77	J/mol×K	676.89	Calculated Property
Cp,gas	476.10	J/mol×K	757.67	Calculated Property
Cp,gas	503.74	J/mol×K	838.44	Calculated Property
Cp,gas	527.23	J/mol×K	919.22	Calculated Property
Cp,gas	547.11	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0384558; 0.0001671]	Pa×s	[268.84; 510.51]	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			-1.47474e+01
Coefficient B			3.08875e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			268.84
Temperature range, max.			510.51
η	0.0384558	Pa×s	268.84	Calculated Property
η	0.0135469	Pa×s	295.69	Calculated Property
η	0.0056776	Pa×s	322.54	Calculated Property
η	0.0027198	Pa×s	349.40	Calculated Property
η	0.0014472	Pa×s	376.25	Calculated Property
η	0.0008376	Pa×s	403.10	Calculated Property
η	0.0005191	Pa×s	429.95	Calculated Property
η	0.0003403	Pa×s	456.81	Calculated Property
η	0.0002338	Pa×s	483.66	Calculated Property
η	0.0001671	Pa×s	510.51	Calculated Property

Similar Compounds

Find more compounds similar to Cyclohexanemethanol, «alpha»,«alpha»,4-trimethyl-, cis-.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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