Chemical Properties of Cyclohexane, 1-(cyclohexylmethyl)-4-(1-methylethyl)-

InChI

InChI=1S/C16H30/c1-13(2)16-10-8-15(9-11-16)12-14-6-4-3-5-7-14/h13-16H,3-12H2,1-2H3

InChI Key

LHWJKUKEUOFSME-UHFFFAOYSA-N

Formula

C16H30

SMILES

CC(C)C1CCC(CC2CCCCC2)CC1

Molecular Weight¹

222.42

Other Names

• Methane, cyclohexyl(4-isopropylcyclohexyl)-

• ω : Acentric Factor.
• Δ_cH°_solid : Standard solid enthalpy of combustion (kJ/mol).
• 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).
• 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	0.3956		Relay (1.0) Calculated Property
ΔcH°solid	[-10200.00; -10180.00]	kJ/mol
ΔcH°solid	-10200.00	kJ/mol	NIST
ΔcH°solid	-10180.00	kJ/mol	NIST
ΔfG°	122.59	kJ/mol	Joback Calculated Property
ΔfH°gas	-315.62	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	18.41	kJ/mol	Joback Calculated Property
ΔvapH°	72.57	kJ/mol	Relay (1.0) Calculated Property
IE	9.25	eV	Relay (1.0) Calculated Property
log10WS	-6.80		Relay (1.0) Calculated Property
logPoct/wat	5.419		Crippen Calculated Property
McVol	214.580	ml/mol	McGowan Calculated Property
Pc	1781.84	kPa	Joback Calculated Property
Tboil	573.11	K	Relay (1.0) Calculated Property
Tc	776.28	K	Relay (1.0) Calculated Property
Tfus	254.49	K	Relay (1.0) Calculated Property
Vc	0.779	m3/kmol	Relay (1.0) Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[270.62; 822.13]	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			-1.38609e+02
Coefficient B			1.74744e+00
Coefficient C			-9.56400e-04
Coefficient D			1.69700e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	270.62	J/mol×K	273.00	Calculated Property
Cp,gas	367.41	J/mol×K	353.78	Calculated Property
Cp,gas	454.07	J/mol×K	434.56	Calculated Property
Cp,gas	531.14	J/mol×K	515.33	Calculated Property
Cp,gas	599.15	J/mol×K	596.11	Calculated Property
Cp,gas	658.64	J/mol×K	676.89	Calculated Property
Cp,gas	710.15	J/mol×K	757.67	Calculated Property
Cp,gas	754.21	J/mol×K	838.44	Calculated Property
Cp,gas	791.36	J/mol×K	919.22	Calculated Property
Cp,gas	822.13	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0091891; 0.0002153]	Pa×s	[265.60; 574.00]	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			-1.16765e+01
Coefficient B			1.85567e+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.			265.60
Temperature range, max.			574.00
η	0.0091891	Pa×s	265.60	Calculated Property
η	0.0041356	Pa×s	299.87	Calculated Property
η	0.0021924	Pa×s	334.13	Calculated Property
η	0.0013079	Pa×s	368.40	Calculated Property
η	0.0008519	Pa×s	402.67	Calculated Property
η	0.0005935	Pa×s	436.93	Calculated Property
η	0.0004358	Pa×s	471.20	Calculated Property
η	0.0003337	Pa×s	505.46	Calculated Property
η	0.0002643	Pa×s	539.73	Calculated Property
η	0.0002153	Pa×s	574.00	Calculated Property

Similar Compounds

Find more compounds similar to Cyclohexane, 1-(cyclohexylmethyl)-4-(1-methylethyl)-.

Sources

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

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