Chemical Properties of Benzoic acid, 4-methylsulfonylamino- (CAS 7151-76-0)

InChI

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

InChI Key

SROHFTOYGFCJAF-UHFFFAOYSA-N

Formula

C8H9NO4S

SMILES

CS(=O)(=O)Nc1ccc(C(=O)O)cc1

Molecular Weight¹

215.23

CAS

7151-76-0

• 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	[357.43; 404.86]	J/mol×K	[658.10; 858.88]
Cp,gas	357.43	J/mol×K	658.10	Joback Calculated Property
Cp,gas	367.01	J/mol×K	691.56	Joback Calculated Property
Cp,gas	375.90	J/mol×K	725.03	Joback Calculated Property
Cp,gas	384.13	J/mol×K	758.49	Joback Calculated Property
Cp,gas	391.69	J/mol×K	791.96	Joback Calculated Property
Cp,gas	398.60	J/mol×K	825.42	Joback Calculated Property
Cp,gas	404.86	J/mol×K	858.88	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzoic acid, 4-methylsulfonylamino-.

Sources

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

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