Chemical Properties of 1-Bromo-2,3,4,5-tetrachloro benzene (CAS 1125-52-6)

InChI

InChI=1S/C6HBrCl4/c7-2-1-3(8)5(10)6(11)4(2)9/h1H

InChI Key

NEPMWYGBQGFJHN-UHFFFAOYSA-N

Formula

C6HBrCl4

SMILES

Clc1cc(Br)c(Cl)c(Cl)c1Cl

Molecular Weight¹

294.79

CAS

1125-52-6

• 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).
• log₁₀WS : Log10 of Water solubility in mol/l.
• 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 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	[153.32; 240.34]	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			8.04800e+01
Coefficient B			3.22300e-01
Coefficient C			-2.18640e-04
Coefficient D			5.62000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	153.32	J/mol×K	273.00	Calculated Property
Cp,gas	169.63	J/mol×K	353.78	Calculated Property
Cp,gas	183.86	J/mol×K	434.56	Calculated Property
Cp,gas	196.20	J/mol×K	515.33	Calculated Property
Cp,gas	206.82	J/mol×K	596.11	Calculated Property
Cp,gas	215.89	J/mol×K	676.89	Calculated Property
Cp,gas	223.61	J/mol×K	757.67	Calculated Property
Cp,gas	230.13	J/mol×K	838.44	Calculated Property
Cp,gas	235.65	J/mol×K	919.22	Calculated Property
Cp,gas	240.34	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0010054; 0.0002817]	Pa×s	[413.36; 602.76]	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			-1.09517e+01
Coefficient B			1.67384e+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.			413.36
Temperature range, max.			602.76
η	0.0010054	Pa×s	413.36	Calculated Property
η	0.0008263	Pa×s	434.40	Calculated Property
η	0.0006915	Pa×s	455.45	Calculated Property
η	0.0005879	Pa×s	476.49	Calculated Property
η	0.0005067	Pa×s	497.54	Calculated Property
η	0.0004421	Pa×s	518.58	Calculated Property
η	0.0003898	Pa×s	539.63	Calculated Property
η	0.0003470	Pa×s	560.67	Calculated Property
η	0.0003114	Pa×s	581.72	Calculated Property
η	0.0002817	Pa×s	602.76	Calculated Property

Similar Compounds

Find more compounds similar to 1-Bromo-2,3,4,5-tetrachloro benzene.

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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