Chemical Properties of Cyclopentane, 1-ethyl-1-methyl-3-(1,5-dimethylhexyl)-2-(2,6,10-trimethylundecyl), isomer # 1

InChI

InChI=1S/C32H64/c1-10-12-17-26(5)18-14-19-27(6)20-15-22-29(8)31-30(23-24-32(31,9)11-2)28(7)21-13-16-25(3)4/h25-31H,10-24H2,1-9H3

InChI Key

ZUAGKGLTGFTOFN-UHFFFAOYSA-N

Formula

C32H64

SMILES

CCCCC(C)CCCC(C)CCCC(C)C1C(C(C)CCCC(C)C)CCC1(C)CC

Molecular Weight¹

448.85

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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	0.8920		Relay (... Calculated Property
ΔfG°	222.00	kJ/mol	Joback Calculated Property
ΔfH°gas	-665.89	kJ/mol	Relay (... Calculated Property
ΔfusH°	50.80	kJ/mol	Joback Calculated Property
ΔvapH°	122.86	kJ/mol	Relay (... Calculated Property
IE	9.21	eV	Relay (... Calculated Property
log10WS	-10.44		Relay (... Calculated Property
logPoct/wat	11.330		Crippen Calculated Property
McVol	450.880	ml/mol	McGowan Calculated Property
Pc	597.50	kPa	Joback Calculated Property
Inp	[2506.00; 2506.00]
Inp	2506.00		NIST
Inp	2506.00		NIST
Tboil	660.39	K	Relay (... Calculated Property
Tc	849.41	K	Relay (... Calculated Property
Tfus	229.54	K	Relay (... Calculated Property
Vc	1.613	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1622.16; 1792.01]	J/mol×K	[935.54; 1145.96]
Cp,gas	1622.16	J/mol×K	935.54	Joback Calculated Property
Cp,gas	1652.34	J/mol×K	970.61	Joback Calculated Property
Cp,gas	1681.55	J/mol×K	1005.68	Joback Calculated Property
Cp,gas	1709.95	J/mol×K	1040.75	Joback Calculated Property
Cp,gas	1737.71	J/mol×K	1075.82	Joback Calculated Property
Cp,gas	1765.01	J/mol×K	1110.89	Joback Calculated Property
Cp,gas	1792.01	J/mol×K	1145.96	Joback Calculated Property

Similar Compounds

Find more compounds similar to Cyclopentane, 1-ethyl-1-methyl-3-(1,5-dimethylhexyl)-2-(2,6,10-trimethylundecyl), isomer # 1.

Sources

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

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