Chemical Properties of Cyclohexane, (1,2-dimethylbutyl)- (CAS 61142-37-8)

InChI

InChI=1S/C12H24/c1-4-10(2)11(3)12-8-6-5-7-9-12/h10-12H,4-9H2,1-3H3

InChI Key

KRDFMOZMKWQTEB-UHFFFAOYSA-N

Formula

C12H24

SMILES

CCC(C)C(C)C1CCCCC1

Molecular Weight¹

168.32

CAS

61142-37-8

• 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).
• 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

Cheméo can also estimate Log10 of Water solubility in mol/l for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[221.30; 624.57]	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			-7.69890e+01
Coefficient B			1.27776e+00
Coefficient C			-7.16400e-04
Coefficient D			1.40200e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	221.30	J/mol×K	273.00	Calculated Property
Cp,gas	291.60	J/mol×K	353.78	Calculated Property
Cp,gas	354.49	J/mol×K	434.56	Calculated Property
Cp,gas	410.42	J/mol×K	515.33	Calculated Property
Cp,gas	459.82	J/mol×K	596.11	Calculated Property
Cp,gas	503.15	J/mol×K	676.89	Calculated Property
Cp,gas	540.85	J/mol×K	757.67	Calculated Property
Cp,gas	573.36	J/mol×K	838.44	Calculated Property
Cp,gas	601.12	J/mol×K	919.22	Calculated Property
Cp,gas	624.57	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0249169; 0.0002205]	Pa×s	[202.38; 485.66]	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			-1.17971e+01
Coefficient B			1.64027e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			202.38
Temperature range, max.			485.66
η	0.0249169	Pa×s	202.38	Calculated Property
η	0.0083702	Pa×s	233.86	Calculated Property
η	0.0036423	Pa×s	265.33	Calculated Property
η	0.0018909	Pa×s	296.81	Calculated Property
η	0.0011131	Pa×s	328.28	Calculated Property
η	0.0007189	Pa×s	359.76	Calculated Property
η	0.0004982	Pa×s	391.23	Calculated Property
η	0.0003646	Pa×s	422.71	Calculated Property
η	0.0002786	Pa×s	454.18	Calculated Property
η	0.0002205	Pa×s	485.66	Calculated Property

Similar Compounds

Find more compounds similar to Cyclohexane, (1,2-dimethylbutyl)-.

Sources

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
These property values are available through the Cheméo API. A free account gives you an access key.