Chemical Properties of Methyl 2-(aminosulfonyl)benzoate (CAS 57683-71-3)

InChI

InChI=1S/C8H9NO4S/c1-13-8(10)6-4-2-3-5-7(6)14(9,11)12/h2-5H,1H3,(H2,9,11,12)

InChI Key

VSOOBQALJVLTBH-UHFFFAOYSA-N

Formula

C8H9NO4S

SMILES

COC(=O)c1ccccc1S(N)(=O)=O

Molecular Weight¹

215.23

CAS

57683-71-3

Other Names

• 2-Carbomethoxybenzenesulfonamide
• Benzoic acid, 2-(aminosulfonyl)-, methyl ester
• Benzoic acid, 2-sulfamoyl-, methyl ester
• 2-Sulfamoylbenzoic acid methyl ester
• 2-Carbomethoxybenzene sulphonamide
• methyl o-sulphamoylbenzoate

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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	[342.59; 399.55]	J/mol×K	[610.70; 831.78]
Cp,gas	342.59	J/mol×K	610.70	Joback Calculated Property
Cp,gas	354.05	J/mol×K	647.55	Joback Calculated Property
Cp,gas	364.73	J/mol×K	684.39	Joback Calculated Property
Cp,gas	374.63	J/mol×K	721.24	Joback Calculated Property
Cp,gas	383.74	J/mol×K	758.09	Joback Calculated Property
Cp,gas	392.05	J/mol×K	794.93	Joback Calculated Property
Cp,gas	399.55	J/mol×K	831.78	Joback Calculated Property

Similar Compounds

Find more compounds similar to Methyl 2-(aminosulfonyl)benzoate.

Sources

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

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