Chemical Properties of Tricyclo[2.2.1.02,6]-heptane, 3-bromo-

InChI

InChI=1S/C7H9Br/c8-7-3-1-4-5(2-3)6(4)7/h3-7H,1-2H2

InChI Key

RDIUINMODIQXGA-UHFFFAOYSA-N

Formula

C7H9Br

SMILES

BrC1C2CC3C(C2)C13

Molecular Weight¹

173.05

Other Names

• Nortricyclyl 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_boilr : Boiling point at reduced pressure (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, 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.

Pressure Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[111.95; 338.51]	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			-1.23890e+02
Coefficient B			1.12590e+00
Coefficient C			-1.07100e-03
Coefficient D			4.07500e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	111.95	J/mol×K	273.00	Calculated Property
Cp,gas	158.43	J/mol×K	353.78	Calculated Property
Cp,gas	196.57	J/mol×K	434.56	Calculated Property
Cp,gas	227.67	J/mol×K	515.33	Calculated Property
Cp,gas	253.01	J/mol×K	596.11	Calculated Property
Cp,gas	273.89	J/mol×K	676.89	Calculated Property
Cp,gas	291.59	J/mol×K	757.67	Calculated Property
Cp,gas	307.40	J/mol×K	838.44	Calculated Property
Cp,gas	322.61	J/mol×K	919.22	Calculated Property
Cp,gas	338.51	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0004286; 0.0021815]	Pa×s	[280.83; 450.05]	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			-3.42740e+00
Coefficient B			-1.21530e+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.			280.83
Temperature range, max.			450.05
η	0.0004286	Pa×s	280.83	Calculated Property
η	0.0005624	Pa×s	299.63	Calculated Property
η	0.0007145	Pa×s	318.43	Calculated Property
η	0.0008840	Pa×s	337.24	Calculated Property
η	0.0010693	Pa×s	356.04	Calculated Property
η	0.0012689	Pa×s	374.84	Calculated Property
η	0.0014815	Pa×s	393.64	Calculated Property
η	0.0017054	Pa×s	412.45	Calculated Property
η	0.0019392	Pa×s	431.25	Calculated Property
η	0.0021815	Pa×s	450.05	Calculated Property

Similar Compounds

Find more compounds similar to Tricyclo[2.2.1.02,6]-heptane, 3-bromo-.

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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