Chemical Properties of 2-Propenoic acid, 2-bromoethyl ester (CAS 4823-47-6)

InChI

InChI=1S/C5H7BrO2/c1-2-5(7)8-4-3-6/h2H,1,3-4H2

InChI Key

CDZAAIHWZYWBSS-UHFFFAOYSA-N

Formula

C5H7BrO2

SMILES

C=CC(=O)OCCBr

Molecular Weight¹

179.01

CAS

4823-47-6

Other Names

• Acrylic acid, 2-bromoethyl ester
• 2-Bromoethyl acrylate

• ω : Acentric Factor.
• 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 for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.

Pressure Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[132.07; 265.95]	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			2.89520e+01
Coefficient B			4.42200e-01
Coefficient C			-2.47900e-04
Coefficient D			4.27000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	132.07	J/mol×K	273.00	Calculated Property
Cp,gas	156.26	J/mol×K	353.78	Calculated Property
Cp,gas	177.80	J/mol×K	434.56	Calculated Property
Cp,gas	196.84	J/mol×K	515.33	Calculated Property
Cp,gas	213.51	J/mol×K	596.11	Calculated Property
Cp,gas	227.93	J/mol×K	676.89	Calculated Property
Cp,gas	240.26	J/mol×K	757.67	Calculated Property
Cp,gas	250.61	J/mol×K	838.44	Calculated Property
Cp,gas	259.13	J/mol×K	919.22	Calculated Property
Cp,gas	265.95	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0038650; 0.0003170]	Pa×s	[246.48; 442.74]	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			-1.11975e+01
Coefficient B			1.39058e+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.			246.48
Temperature range, max.			442.74
η	0.0038650	Pa×s	246.48	Calculated Property
η	0.0024434	Pa×s	268.29	Calculated Property
η	0.0016549	Pa×s	290.09	Calculated Property
η	0.0011837	Pa×s	311.90	Calculated Property
η	0.0008845	Pa×s	333.71	Calculated Property
η	0.0006850	Pa×s	355.51	Calculated Property
η	0.0005464	Pa×s	377.32	Calculated Property
η	0.0004468	Pa×s	399.13	Calculated Property
η	0.0003730	Pa×s	420.94	Calculated Property
η	0.0003170	Pa×s	442.74	Calculated Property

Similar Compounds

Find more compounds similar to 2-Propenoic acid, 2-bromoethyl ester.

Sources

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

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