Chemical Properties of Cyclohexane, 2-(1-decylundecyl)-1,4-dimethyl- (CAS 55429-27-1)

InChI

InChI=1S/C29H58/c1-5-7-9-11-13-15-17-19-21-28(29-25-26(3)23-24-27(29)4)22-20-18-16-14-12-10-8-6-2/h26-29H,5-25H2,1-4H3

InChI Key

UPYOZECJBFFKFT-UHFFFAOYSA-N

Formula

C29H58

SMILES

CCCCCCCCCCC(CCCCCCCCCC)C1CC(C)CCC1C

Molecular Weight¹

406.77

CAS

55429-27-1

Other Names

• 11-(2,5-Dimethylcyclohexyl)heneicosane

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[586.78; 1514.40]	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			-7.88820e+01
Coefficient B			2.83388e+00
Coefficient C			-1.52720e-03
Coefficient D			2.86600e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	586.78	J/mol×K	273.00	Calculated Property
Cp,gas	745.23	J/mol×K	353.78	Calculated Property
Cp,gas	887.72	J/mol×K	434.56	Calculated Property
Cp,gas	1015.16	J/mol×K	515.33	Calculated Property
Cp,gas	1128.45	J/mol×K	596.11	Calculated Property
Cp,gas	1228.49	J/mol×K	676.89	Calculated Property
Cp,gas	1316.21	J/mol×K	757.67	Calculated Property
Cp,gas	1392.49	J/mol×K	838.44	Calculated Property
Cp,gas	1458.25	J/mol×K	919.22	Calculated Property
Cp,gas	1514.40	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0017563; 0.0000759]	Pa×s	[400.49; 748.07]	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			-1.31057e+01
Coefficient B			2.70779e+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.			400.49
Temperature range, max.			748.07
η	0.0017563	Pa×s	400.49	Calculated Property
η	0.0009691	Pa×s	439.11	Calculated Property
η	0.0005886	Pa×s	477.73	Calculated Property
η	0.0003852	Pa×s	516.35	Calculated Property
η	0.0002675	Pa×s	554.97	Calculated Property
η	0.0001947	Pa×s	593.59	Calculated Property
η	0.0001474	Pa×s	632.21	Calculated Property
η	0.0001152	Pa×s	670.83	Calculated Property
η	0.0000924	Pa×s	709.45	Calculated Property
η	0.0000759	Pa×s	748.07	Calculated Property

Similar Compounds

Find more compounds similar to Cyclohexane, 2-(1-decylundecyl)-1,4-dimethyl-.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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