Chemical Properties of Methylcyclododecane

InChI

InChI=1S/C13H26/c1-13-11-9-7-5-3-2-4-6-8-10-12-13/h13H,2-12H2,1H3

InChI Key

MAJAJAXSPRXRRS-UHFFFAOYSA-N

Formula

C13H26

SMILES

CC1CCCCCCCCCCC1

Molecular Weight¹

182.35

Other Names

• Cyclododecane, methyl

• 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.
• 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	0.2242		Relay (1.0) Calculated Property
ΔfG°	10.43	kJ/mol	Joback Calculated Property
ΔfH°gas	-305.44	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	8.66	kJ/mol	Joback Calculated Property
ΔvapH°	58.75	kJ/mol	Relay (1.0) Calculated Property
IE	9.57	eV	Relay (1.0) Calculated Property
log10WS	-5.80		Relay (1.0) Calculated Property
logPoct/wat	4.927		Crippen Calculated Property
McVol	183.170	ml/mol	McGowan Calculated Property
Pc	2244.00	kPa	Joback Calculated Property
Inp	[1379.00; 1386.00]
Inp	1386.00		NIST
Inp	1379.00		NIST
Tboil	525.31	K	Relay (1.0) Calculated Property
Tc	724.12	K	Relay (1.0) Calculated Property
Tfus	259.79	K	Relay (1.0) Calculated Property
Vc	0.621	m3/kmol	Relay (1.0) Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[213.79; 685.76]	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			-1.05260e+02
Coefficient B			1.30332e+00
Coefficient C			-4.86000e-04
Coefficient D			-2.63000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	213.79	J/mol×K	273.00	Calculated Property
Cp,gas	293.83	J/mol×K	353.78	Calculated Property
Cp,gas	367.17	J/mol×K	434.56	Calculated Property
Cp,gas	433.72	J/mol×K	515.33	Calculated Property
Cp,gas	493.39	J/mol×K	596.11	Calculated Property
Cp,gas	546.11	J/mol×K	676.89	Calculated Property
Cp,gas	591.79	J/mol×K	757.67	Calculated Property
Cp,gas	630.35	J/mol×K	838.44	Calculated Property
Cp,gas	661.70	J/mol×K	919.22	Calculated Property
Cp,gas	685.76	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.1307048; 0.0000530]	Pa×s	[222.53; 544.58]	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			-1.52421e+01
Coefficient B			2.93901e+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.			222.53
Temperature range, max.			544.58
η	0.1307048	Pa×s	222.53	Calculated Property
η	0.0209759	Pa×s	258.31	Calculated Property
η	0.0052542	Pa×s	294.10	Calculated Property
η	0.0017771	Pa×s	329.88	Calculated Property
η	0.0007432	Pa×s	365.66	Calculated Property
η	0.0003630	Pa×s	401.45	Calculated Property
η	0.0001994	Pa×s	437.23	Calculated Property
η	0.0001199	Pa×s	473.01	Calculated Property
η	0.0000775	Pa×s	508.80	Calculated Property
η	0.0000530	Pa×s	544.58	Calculated Property

Similar Compounds

Find more compounds similar to Methylcyclododecane.

Sources

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

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