Chemical Properties of Ethyl 2-(4-bromophenyl)acetate (CAS 14062-25-0)

InChI

InChI=1S/C10H11BrO2/c1-2-13-10(12)7-8-3-5-9(11)6-4-8/h3-6H,2,7H2,1H3

InChI Key

ZFDCWHPNBWPPHG-UHFFFAOYSA-N

Formula

C10H11BrO2

SMILES

CCOC(=O)Cc1ccc(Br)cc1

Molecular Weight¹

243.10

CAS

14062-25-0

Other Names

• Benzeneacetic acid, 4-bromo-, ethyl ester
• Ethyl (4-bromophenyl)acetate
• 4-Bromophenylacetic acid ethyl ester

• 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).
• I_np : Non-polar retention indices.
• 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	[193.24; 430.85]	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			7.79200e+00
Coefficient B			7.98820e-01
Coefficient C			-4.61160e-04
Coefficient D			8.54000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	193.24	J/mol×K	273.00	Calculated Property
Cp,gas	236.46	J/mol×K	353.78	Calculated Property
Cp,gas	274.85	J/mol×K	434.56	Calculated Property
Cp,gas	308.67	J/mol×K	515.33	Calculated Property
Cp,gas	338.20	J/mol×K	596.11	Calculated Property
Cp,gas	363.70	J/mol×K	676.89	Calculated Property
Cp,gas	385.44	J/mol×K	757.67	Calculated Property
Cp,gas	403.70	J/mol×K	838.44	Calculated Property
Cp,gas	418.75	J/mol×K	919.22	Calculated Property
Cp,gas	430.85	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0019162; 0.0002150]	Pa×s	[343.53; 566.58]	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			-1.18135e+01
Coefficient B			1.90870e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			343.53
Temperature range, max.			566.58
η	0.0019162	Pa×s	343.53	Calculated Property
η	0.0013185	Pa×s	368.31	Calculated Property
η	0.0009510	Pa×s	393.10	Calculated Property
η	0.0007131	Pa×s	417.88	Calculated Property
η	0.0005522	Pa×s	442.66	Calculated Property
η	0.0004393	Pa×s	467.45	Calculated Property
η	0.0003577	Pa×s	492.23	Calculated Property
η	0.0002970	Pa×s	517.01	Calculated Property
η	0.0002509	Pa×s	541.80	Calculated Property
η	0.0002150	Pa×s	566.58	Calculated Property

Similar Compounds

Find more compounds similar to Ethyl 2-(4-bromophenyl)acetate.

Sources

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

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