Chemical Properties of PENTABROMOETHANE

InChI

InChI=1S/C2HBr5/c3-1(4)2(5,6)7/h1H

InChI Key

OGVPXEPSTZMAFF-UHFFFAOYSA-N

Formula

C2HBr5

SMILES

BrC(Br)C(Br)(Br)Br

Molecular Weight¹

424.55

Other Names

• Ethane, pentabromo-

• 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	[116.07; 169.87]	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			1.58700e+01
Coefficient B			5.16500e-01
Coefficient C			-6.17000e-04
Coefficient D			2.54500e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	116.07	J/mol×K	273.00	Calculated Property
Cp,gas	132.64	J/mol×K	353.78	Calculated Property
Cp,gas	144.69	J/mol×K	434.56	Calculated Property
Cp,gas	153.01	J/mol×K	515.33	Calculated Property
Cp,gas	158.42	J/mol×K	596.11	Calculated Property
Cp,gas	161.72	J/mol×K	676.89	Calculated Property
Cp,gas	163.70	J/mol×K	757.67	Calculated Property
Cp,gas	165.19	J/mol×K	838.44	Calculated Property
Cp,gas	166.98	J/mol×K	919.22	Calculated Property
Cp,gas	169.87	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0056838; 0.0002723]	Pa×s	[329.65; 604.95]	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			-1.18470e+01
Coefficient B			2.20102e+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.			329.65
Temperature range, max.			604.95
η	0.0056838	Pa×s	329.65	Calculated Property
η	0.0032241	Pa×s	360.24	Calculated Property
η	0.0019986	Pa×s	390.83	Calculated Property
η	0.0013280	Pa×s	421.42	Calculated Property
η	0.0009326	Pa×s	452.01	Calculated Property
η	0.0006849	Pa×s	482.60	Calculated Property
η	0.0005219	Pa×s	513.19	Calculated Property
η	0.0004100	Pa×s	543.78	Calculated Property
η	0.0003305	Pa×s	574.36	Calculated Property
η	0.0002723	Pa×s	604.95	Calculated Property

Similar Compounds

Find more compounds similar to PENTABROMOETHANE.

Sources

• Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) ChEDL chemicals 1.5.2, from Bradley, J.-C.; Williams, A.; Lang, A. Jean-Claude Bradley Open Melting Point Dataset. Figshare, 2014 (CC0).
• 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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