Chemical Properties of Bicyclo[2.2.1]hept-2-ene,5-bromo-,endo-

InChI

InChI=1S/C7H9Br/c8-7-4-5-1-2-6(7)3-5/h1-2,5-7H,3-4H2/t5-,6+,7-/m0/s1

InChI Key

DWPPXNJBRSZQHD-XVMARJQXSA-N

Formula

C7H9Br

SMILES

Br[C@H]1C[C@H]2C=C[C@@H]1C2

Molecular Weight¹

173.05

• 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).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal melting (fusion) point, 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	[111.98; 326.15]	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			-8.71700e+01
Coefficient B			9.16700e-01
Coefficient C			-7.54280e-04
Coefficient D			2.50900e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	111.98	J/mol×K	273.00	Calculated Property
Cp,gas	153.84	J/mol×K	353.78	Calculated Property
Cp,gas	189.34	J/mol×K	434.56	Calculated Property
Cp,gas	219.26	J/mol×K	515.33	Calculated Property
Cp,gas	244.40	J/mol×K	596.11	Calculated Property
Cp,gas	265.55	J/mol×K	676.89	Calculated Property
Cp,gas	283.51	J/mol×K	757.67	Calculated Property
Cp,gas	299.07	J/mol×K	838.44	Calculated Property
Cp,gas	313.02	J/mol×K	919.22	Calculated Property
Cp,gas	326.15	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0009362; 0.0007973]	Pa×s	[257.33; 464.83]	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			-7.33340e+00
Coefficient B			9.25800e+01
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.			257.33
Temperature range, max.			464.83
η	0.0009362	Pa×s	257.33	Calculated Property
η	0.0009090	Pa×s	280.39	Calculated Property
η	0.0008864	Pa×s	303.44	Calculated Property
η	0.0008675	Pa×s	326.50	Calculated Property
η	0.0008515	Pa×s	349.55	Calculated Property
η	0.0008376	Pa×s	372.61	Calculated Property
η	0.0008256	Pa×s	395.67	Calculated Property
η	0.0008150	Pa×s	418.72	Calculated Property
η	0.0008057	Pa×s	441.78	Calculated Property
η	0.0007973	Pa×s	464.83	Calculated Property

Similar Compounds

Find more compounds similar to Bicyclo[2.2.1]hept-2-ene,5-bromo-,endo-.

Sources

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

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