Chemical Properties of Cyclohexane, 1-bromo-2-chloro-, cis- (CAS 51422-75-4)

InChI

InChI=1S/C6H10BrCl/c7-5-3-1-2-4-6(5)8/h5-6H,1-4H2/t5-,6+/m1/s1

InChI Key

YUIQHWAQFBGYLI-RITPCOANSA-N

Formula

C6H10BrCl

SMILES

ClC1CCCCC1Br

Molecular Weight¹

197.50

CAS

51422-75-4

Other Names

• cis-1-Bromo-2-Chlorocyclohexane
• cis-2-Chlorocyclohexyl Bromide

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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).
• T_boil : Normal Boiling Point Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, 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	[124.30; 337.95]	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			-4.11500e+01
Coefficient B			7.14400e-01
Coefficient C			-4.20000e-04
Coefficient D			8.47000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	124.30	J/mol×K	273.00	Calculated Property
Cp,gas	162.77	J/mol×K	353.78	Calculated Property
Cp,gas	196.93	J/mol×K	434.56	Calculated Property
Cp,gas	227.06	J/mol×K	515.33	Calculated Property
Cp,gas	253.41	J/mol×K	596.11	Calculated Property
Cp,gas	276.25	J/mol×K	676.89	Calculated Property
Cp,gas	295.86	J/mol×K	757.67	Calculated Property
Cp,gas	312.50	J/mol×K	838.44	Calculated Property
Cp,gas	326.44	J/mol×K	919.22	Calculated Property
Cp,gas	337.95	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0035866; 0.0003521]	Pa×s	[250.24; 481.97]	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			-1.04582e+01
Coefficient B			1.20808e+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.			250.24
Temperature range, max.			481.97
η	0.0035866	Pa×s	250.24	Calculated Property
η	0.0022860	Pa×s	275.99	Calculated Property
η	0.0015735	Pa×s	301.74	Calculated Property
η	0.0011485	Pa×s	327.48	Calculated Property
η	0.0008777	Pa×s	353.23	Calculated Property
η	0.0006957	Pa×s	378.98	Calculated Property
η	0.0005680	Pa×s	404.73	Calculated Property
η	0.0004752	Pa×s	430.48	Calculated Property
η	0.0004056	Pa×s	456.22	Calculated Property
η	0.0003521	Pa×s	481.97	Calculated Property

Similar Compounds

Find more compounds similar to Cyclohexane, 1-bromo-2-chloro-, cis-.

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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