Chemical Properties of meso-3,4-dibromohexane

InChI

InChI=1S/C6H12Br2/c1-3-5(7)6(8)4-2/h5-6H,3-4H2,1-2H3/t5-,6+

InChI Key

VCQBYNRFLHNSKA-OLQVQODUSA-N

Formula

C6H12Br2

SMILES

CC[C@@H](Br)[C@@H](Br)CC

Molecular Weight¹

243.97

• ω : Acentric Factor.
• 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).
• 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

Cheméo can also estimate Standard Gibbs free energy of formation, 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	[160.11; 348.09]	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			1.04520e+01
Coefficient B			6.62040e-01
Coefficient C			-4.51800e-04
Coefficient D			1.27400e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	160.11	J/mol×K	273.00	Calculated Property
Cp,gas	193.76	J/mol×K	353.78	Calculated Property
Cp,gas	223.28	J/mol×K	434.56	Calculated Property
Cp,gas	249.07	J/mol×K	515.33	Calculated Property
Cp,gas	271.54	J/mol×K	596.11	Calculated Property
Cp,gas	291.09	J/mol×K	676.89	Calculated Property
Cp,gas	308.11	J/mol×K	757.67	Calculated Property
Cp,gas	323.02	J/mol×K	838.44	Calculated Property
Cp,gas	336.21	J/mol×K	919.22	Calculated Property
Cp,gas	348.09	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0061816; 0.0003205]	Pa×s	[246.98; 475.60]	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			-1.12430e+01
Coefficient B			1.52060e+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.			246.98
Temperature range, max.			475.60
η	0.0061816	Pa×s	246.98	Calculated Property
η	0.0034813	Pa×s	272.38	Calculated Property
η	0.0021623	Pa×s	297.78	Calculated Property
η	0.0014475	Pa×s	323.19	Calculated Property
η	0.0010273	Pa×s	348.59	Calculated Property
η	0.0007639	Pa×s	373.99	Calculated Property
η	0.0005898	Pa×s	399.39	Calculated Property
η	0.0004697	Pa×s	424.80	Calculated Property
η	0.0003838	Pa×s	450.20	Calculated Property
η	0.0003205	Pa×s	475.60	Calculated Property

Similar Compounds

Find more compounds similar to meso-3,4-dibromohexane.

Sources

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

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