Chemical Properties of Cycloundecane (CAS 294-41-7)

InChI

InChI=1S/C11H22/c1-2-4-6-8-10-11-9-7-5-3-1/h1-11H2

InChI Key

KYTNZWVKKKJXFS-UHFFFAOYSA-N

Formula

C11H22

SMILES

C1CCCCCCCCCC1

Molecular Weight¹

154.29

CAS

294-41-7

• ω : Acentric Factor.
• Δ_cH°_liquid : Standard liquid 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).
• P_vap : Vapor pressure (kPa).
• I_np : Non-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	0.2154		Relay (1.0) Calculated Property
ΔcH°liquid	-7237.30 ± 1.10	kJ/mol	NIST
ΔfG°	13.40	kJ/mol	Joback Calculated Property
ΔfH°gas	-246.51	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	4.51	kJ/mol	Joback Calculated Property
ΔvapH°	55.52	kJ/mol	Relay (1.0) Calculated Property
IE	9.73	eV	Relay (1.0) Calculated Property
log10WS	-5.18		Relay (1.0) Calculated Property
logPoct/wat	4.291		Crippen Calculated Property
McVol	154.990	ml/mol	McGowan Calculated Property
Pc	2738.28	kPa	Joback Calculated Property
Inp	[1225.40; 1292.00]
Inp	1225.40		NIST
Inp	1235.00		NIST
Inp	1235.00		NIST
Inp	1292.00		NIST
Inp	1292.00		NIST
Inp	1292.00		NIST
Inp	1225.40		NIST
Tboil	453.00 ± 4.00	K	NIST
Tc	694.45	K	Relay (1.0) Calculated Property
Tfus	266.15	K	Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) Compiled value
Vc	0.549	m3/kmol	Relay (1.0) Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[173.99; 574.14]	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			-1.04260e+02
Coefficient B			1.14940e+00
Coefficient C			-4.79000e-04
Coefficient D			8.00000e-09
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	173.99	J/mol×K	273.00	Calculated Property
Cp,gas	242.78	J/mol×K	353.78	Calculated Property
Cp,gas	305.42	J/mol×K	434.56	Calculated Property
Cp,gas	361.95	J/mol×K	515.33	Calculated Property
Cp,gas	412.39	J/mol×K	596.11	Calculated Property
Cp,gas	456.77	J/mol×K	676.89	Calculated Property
Cp,gas	495.11	J/mol×K	757.67	Calculated Property
Cp,gas	527.43	J/mol×K	838.44	Calculated Property
Cp,gas	553.77	J/mol×K	919.22	Calculated Property
Cp,gas	574.14	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0113668; 0.0000740]	Pa×s	[266.15; 512.93]	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			-1.49411e+01
Coefficient B			2.78501e+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.			266.15
Temperature range, max.			512.93
η	0.0113668	Pa×s	266.15	Calculated Property
η	0.0042773	Pa×s	293.57	Calculated Property
η	0.0019020	Pa×s	320.99	Calculated Property
η	0.0009609	Pa×s	348.41	Calculated Property
η	0.0005363	Pa×s	375.83	Calculated Property
η	0.0003240	Pa×s	403.25	Calculated Property
η	0.0002087	Pa×s	430.67	Calculated Property
η	0.0001417	Pa×s	458.09	Calculated Property
η	0.0001005	Pa×s	485.51	Calculated Property
η	0.0000740	Pa×s	512.93	Calculated Property

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.63]	kPa	[364.56; 515.42]	The Yaws Handbook of Vapor Pressure
Equation			ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K
Coefficient A			1.49166e+01
Coefficient B			-4.21936e+03
Coefficient C			-7.61400e+01
Temperature range, min.			364.56
Temperature range, max.			515.42
Pvap	1.33	kPa	364.56	Calculated Property
Pvap	2.98	kPa	381.32	Calculated Property
Pvap	6.11	kPa	398.08	Calculated Property
Pvap	11.70	kPa	414.85	Calculated Property
Pvap	21.05	kPa	431.61	Calculated Property
Pvap	35.92	kPa	448.37	Calculated Property
Pvap	58.54	kPa	465.13	Calculated Property
Pvap	91.63	kPa	481.90	Calculated Property
Pvap	138.42	kPa	498.66	Calculated Property
Pvap	202.63	kPa	515.42	Calculated Property

Similar Compounds

Find more compounds similar to Cycloundecane.

Sources

• Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) ChEDL chemicals 1.5.2, from Bradley, J.-C.; Williams, A.; Lang, A. Jean-Claude Bradley Open Melting Point Dataset. Figshare, 2014 (CC0).
• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure

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