Chemical Properties of 2-Propanone, 1-cyclohexyl- (CAS 103-78-6)

InChI

InChI=1S/C9H16O/c1-8(10)7-9-5-3-2-4-6-9/h9H,2-7H2,1H3

InChI Key

UHBZEAPZATVYKV-UHFFFAOYSA-N

Formula

C9H16O

SMILES

CC(=O)CC1CCCCC1

Molecular Weight¹

140.22

CAS

103-78-6

Other Names

• 1-Cyclohexyl-2-propanone
• Acetonylcyclohexane
• Cyclohexyl-2-propanone
• Cyclohexylacetone

• 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).
• 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

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[159.21; 457.74]	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			-6.35390e+01
Coefficient B			9.52920e-01
Coefficient C			-5.28100e-04
Coefficient D			9.64600e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	159.21	J/mol×K	273.00	Calculated Property
Cp,gas	211.76	J/mol×K	353.78	Calculated Property
Cp,gas	258.75	J/mol×K	434.56	Calculated Property
Cp,gas	300.49	J/mol×K	515.33	Calculated Property
Cp,gas	337.28	J/mol×K	596.11	Calculated Property
Cp,gas	369.43	J/mol×K	676.89	Calculated Property
Cp,gas	397.25	J/mol×K	757.67	Calculated Property
Cp,gas	421.04	J/mol×K	838.44	Calculated Property
Cp,gas	441.10	J/mol×K	919.22	Calculated Property
Cp,gas	457.74	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0060031; 0.0003040]	Pa×s	[248.50; 482.53]	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			-1.12657e+01
Coefficient B			1.52834e+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.			248.50
Temperature range, max.			482.53
η	0.0060031	Pa×s	248.50	Calculated Property
η	0.0033524	Pa×s	274.50	Calculated Property
η	0.0020707	Pa×s	300.51	Calculated Property
η	0.0013811	Pa×s	326.51	Calculated Property
η	0.0009778	Pa×s	352.51	Calculated Property
η	0.0007260	Pa×s	378.52	Calculated Property
η	0.0005600	Pa×s	404.52	Calculated Property
η	0.0004457	Pa×s	430.52	Calculated Property
η	0.0003641	Pa×s	456.52	Calculated Property
η	0.0003040	Pa×s	482.53	Calculated Property

Similar Compounds

Find more compounds similar to 2-Propanone, 1-cyclohexyl-.

Sources

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

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