Chemical Properties of Phenanthrene, 9-bromo- (CAS 573-17-1)

InChI

InChI=1S/C14H9Br/c15-14-9-10-5-1-2-6-11(10)12-7-3-4-8-13(12)14/h1-9H

InChI Key

RSQXKVWKJVUZDG-UHFFFAOYSA-N

Formula

C14H9Br

SMILES

Brc1cc2ccccc2c2ccccc12

Molecular Weight¹

257.12

CAS

573-17-1

Other Names

• 9-Bromophenanthrene
• 9-Phenanthryl bromide
• 9-Phenathryl 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).
• log₁₀WS : Log10 of Water solubility in mol/l.
• 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_boilr : Boiling point at reduced pressure (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, 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.

Pressure Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[182.31; 444.50]	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			-6.98400e+01
Coefficient B			1.16670e+00
Coefficient C			-9.79760e-04
Coefficient D			3.27400e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	182.31	J/mol×K	273.00	Calculated Property
Cp,gas	234.78	J/mol×K	353.78	Calculated Property
Cp,gas	279.01	J/mol×K	434.56	Calculated Property
Cp,gas	316.01	J/mol×K	515.33	Calculated Property
Cp,gas	346.84	J/mol×K	596.11	Calculated Property
Cp,gas	372.52	J/mol×K	676.89	Calculated Property
Cp,gas	394.09	J/mol×K	757.67	Calculated Property
Cp,gas	412.59	J/mol×K	838.44	Calculated Property
Cp,gas	429.05	J/mol×K	919.22	Calculated Property
Cp,gas	444.50	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0014982; 0.0005392]	Pa×s	[424.20; 649.64]	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			-9.44842e+00
Coefficient B			1.24924e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			424.20
Temperature range, max.			649.64
η	0.0014982	Pa×s	424.20	Calculated Property
η	0.0012713	Pa×s	449.25	Calculated Property
η	0.0010977	Pa×s	474.30	Calculated Property
η	0.0009618	Pa×s	499.35	Calculated Property
η	0.0008535	Pa×s	524.40	Calculated Property
η	0.0007657	Pa×s	549.44	Calculated Property
η	0.0006934	Pa×s	574.49	Calculated Property
η	0.0006332	Pa×s	599.54	Calculated Property
η	0.0005824	Pa×s	624.59	Calculated Property
η	0.0005392	Pa×s	649.64	Calculated Property

Similar Compounds

Find more compounds similar to Phenanthrene, 9-bromo-.

Sources

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

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