Chemical Properties of 2-Bromo-4,5-dimethoxyphenylacetic acid (CAS 4697-62-5)

InChI

InChI=1S/C10H11BrO4/c1-14-8-3-6(4-10(12)13)7(11)5-9(8)15-2/h3,5H,4H2,1-2H3,(H,12,13)

InChI Key

MDOLAGJKKZEHHW-UHFFFAOYSA-N

Formula

C10H11BrO4

SMILES

COc1cc(Br)c(CC(=O)O)cc1OC

Molecular Weight¹

275.10

CAS

4697-62-5

• 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).
• 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

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[403.22; 451.32]	J/mol×K	[726.87; 937.08]
Cp,gas	403.22	J/mol×K	726.87	Joback Calculated Property
Cp,gas	412.78	J/mol×K	761.90	Joback Calculated Property
Cp,gas	421.72	J/mol×K	796.94	Joback Calculated Property
Cp,gas	430.05	J/mol×K	831.97	Joback Calculated Property
Cp,gas	437.77	J/mol×K	867.01	Joback Calculated Property
Cp,gas	444.86	J/mol×K	902.04	Joback Calculated Property
Cp,gas	451.32	J/mol×K	937.08	Joback Calculated Property
η	[0.0000370; 0.0004701]	Pa×s	[481.45; 726.87]
η	0.0004701	Pa×s	481.45	Joback Calculated Property
η	0.0002606	Pa×s	522.35	Joback Calculated Property
η	0.0001574	Pa×s	563.26	Joback Calculated Property
η	0.0001018	Pa×s	604.16	Joback Calculated Property
η	0.0000696	Pa×s	645.06	Joback Calculated Property
η	0.0000498	Pa×s	685.97	Joback Calculated Property
η	0.0000370	Pa×s	726.87	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2-Bromo-4,5-dimethoxyphenylacetic acid.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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