Chemical Properties of Benzene, 1-bromo-4-(2-phenylethyl)- (CAS 14310-24-8)

InChI

InChI=1S/C14H13Br/c15-14-10-8-13(9-11-14)7-6-12-4-2-1-3-5-12/h1-5,8-11H,6-7H2

InChI Key

FTRWFZZSIXRXFI-UHFFFAOYSA-N

Formula

C14H13Br

SMILES

Brc1ccc(CCc2ccccc2)cc1

Molecular Weight¹

261.16

CAS

14310-24-8

Other Names

• Bibenzyl, 4-bromo-
• 4-Bromobibenzyl
• 1-(4-Bromophenyl)-2-phenylethane

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• 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_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

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[204.50; 510.58]	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			-5.51580e+01
Coefficient B			1.15470e+00
Coefficient C			-8.04560e-04
Coefficient D			2.15600e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	204.50	J/mol×K	273.00	Calculated Property
Cp,gas	262.20	J/mol×K	353.78	Calculated Property
Cp,gas	312.38	J/mol×K	434.56	Calculated Property
Cp,gas	355.74	J/mol×K	515.33	Calculated Property
Cp,gas	392.94	J/mol×K	596.11	Calculated Property
Cp,gas	424.68	J/mol×K	676.89	Calculated Property
Cp,gas	451.63	J/mol×K	757.67	Calculated Property
Cp,gas	474.48	J/mol×K	838.44	Calculated Property
Cp,gas	493.90	J/mol×K	919.22	Calculated Property
Cp,gas	510.58	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0015353; 0.0001868]	Pa×s	[372.70; 628.47]	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			-1.16549e+01
Coefficient B			1.92904e+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.			372.70
Temperature range, max.			628.47
η	0.0015353	Pa×s	372.70	Calculated Property
η	0.0010640	Pa×s	401.12	Calculated Property
η	0.0007740	Pa×s	429.54	Calculated Property
η	0.0005858	Pa×s	457.96	Calculated Property
η	0.0004580	Pa×s	486.37	Calculated Property
η	0.0003679	Pa×s	514.79	Calculated Property
η	0.0003024	Pa×s	543.21	Calculated Property
η	0.0002535	Pa×s	571.63	Calculated Property
η	0.0002160	Pa×s	600.05	Calculated Property
η	0.0001868	Pa×s	628.47	Calculated Property

Similar Compounds

Find more compounds similar to Benzene, 1-bromo-4-(2-phenylethyl)-.

Sources

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

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