4-amino-N-(4-nitrophenyl)benzenesulfonamide

InChI: InChI=1S/C12H11N3O4S/c13-9-1-7-12(8-2-9)20(18,19)14-10-3-5-11(6-4-10)15(16)17/h1-8,14H,13H2
InChI Key: ACJNABKXDUDYAM-UHFFFAOYSA-N
Formula: C12H11N3O4S
SMILES: Nc1ccc(S(=O)(=O)Nc2ccc([N+](=O)[O-])cc2)cc1
Molecular Weight¹: 293.30

ω : Acentric Factor.
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).
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).
P_sub : Sublimation 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.

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Physical Properties

Property	Value	Unit	Source
ω	0.8431		Relay (1.0) Calculated Property
Δ_fG°	-21.43	kJ/mol	Joback Calculated Property
Δ_fH°_gas	-138.07	kJ/mol	Relay (1.0) Calculated Property
Δ_fusH°	[27.90; 27.90]	kJ/mol
Δ_fusH°	27.90	kJ/mol	Thermodynamic aspects of solubility, solvation and partitioning processes of some sulfonamides
Δ_fusH°	27.90 ± 0.50	kJ/mol	Impact of Sulfonamide Structure on Solubility and Transfer Processes in Biologically Relevant Solvents
Δ_vapH°	119.72	kJ/mol	Relay (1.0) Calculated Property
IE	7.90	eV	Relay (1.0) Calculated Property
log₁₀WS	-3.53		Relay (1.0) Calculated Property
logP_oct/wat	1.978		Crippen Calculated Property
McVol	197.890	ml/mol	McGowan Calculated Property
P_c	4438.52	kPa	Joback Calculated Property
T_boil	688.67	K	Relay (1.0) Calculated Property
T_c	1052.59	K	Relay (1.0) Calculated Property
T_fus	[438.90; 439.00]	K
T_fus	438.90	K	Thermodynamic aspects of solubility, solvation and partitioning processes of some sulfonamides
T_fus	439.00 ± 0.20	K	Impact of Sulfonamide Structure on Solubility and Transfer Processes in Biologically Relevant Solvents
V_c	0.667	m³/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
C_p,gas	[556.24; 596.62]	J/mol×K	[859.60; 1119.77]

C_p,gas	556.24	J/mol×K	859.60	Joback Calculated Property
C_p,gas	566.19	J/mol×K	902.96	Joback Calculated Property
C_p,gas	574.78	J/mol×K	946.32	Joback Calculated Property
C_p,gas	582.06	J/mol×K	989.69	Joback Calculated Property
C_p,gas	588.10	J/mol×K	1033.05	Joback Calculated Property
C_p,gas	592.93	J/mol×K	1076.41	Joback Calculated Property
C_p,gas	596.62	J/mol×K	1119.77	Joback Calculated Property
P_sub	[1.50e-06; 2.28e-05]	kPa	[405.55; 438.25]

P_sub	1.50e-06	kPa	405.55	Thermodynamic aspects of solubility, solvation and partitioning processes of some sulfonamides
P_sub	2.18e-06	kPa	409.45	Thermodynamic aspects of solubility, solvation and partitioning processes of some sulfonamides
P_sub	2.30e-06	kPa	412.85	Thermodynamic aspects of solubility, solvation and partitioning processes of some sulfonamides
P_sub	3.41e-06	kPa	415.15	Thermodynamic aspects of solubility, solvation and partitioning processes of some sulfonamides
P_sub	4.01e-06	kPa	417.25	Thermodynamic aspects of solubility, solvation and partitioning processes of some sulfonamides
P_sub	4.34e-06	kPa	418.75	Thermodynamic aspects of solubility, solvation and partitioning processes of some sulfonamides
P_sub	5.46e-06	kPa	420.05	Thermodynamic aspects of solubility, solvation and partitioning processes of some sulfonamides
P_sub	5.63e-06	kPa	421.55	Thermodynamic aspects of solubility, solvation and partitioning processes of some sulfonamides
P_sub	6.16e-06	kPa	423.25	Thermodynamic aspects of solubility, solvation and partitioning processes of some sulfonamides
P_sub	7.30e-06	kPa	424.65	Thermodynamic aspects of solubility, solvation and partitioning processes of some sulfonamides
P_sub	8.92e-06	kPa	426.25	Thermodynamic aspects of solubility, solvation and partitioning processes of some sulfonamides
P_sub	1.05e-05	kPa	428.75	Thermodynamic aspects of solubility, solvation and partitioning processes of some sulfonamides
P_sub	1.28e-05	kPa	431.35	Thermodynamic aspects of solubility, solvation and partitioning processes of some sulfonamides
P_sub	1.41e-05	kPa	432.05	Thermodynamic aspects of solubility, solvation and partitioning processes of some sulfonamides
P_sub	1.81e-05	kPa	435.15	Thermodynamic aspects of solubility, solvation and partitioning processes of some sulfonamides
P_sub	2.28e-05	kPa	438.25	Thermodynamic aspects of solubility, solvation and partitioning processes of some sulfonamides

Similar Compounds

4-[(4-aminophenyl)sulfonylamino]benzenesulfonamide.

4-amino-N-(4-chlorophenyl)benzenesulfonamide.

4-amino-N-(4-cyanophenyl)benzenesulfonamide.

Benzenesulfonamide, 4-amino-N-(3,4-dichlorophenyl)-.

Benzenesulfonamide, 4-amino-N-(4-methoxyphenyl)-.

4-amino-N-(4-methoxyphenyl)benzenesulfonamide.

Aniline, n,n-dimethyl-p-phenylsulfonamido-.

Aniline, n,n-dimethyl-p-(p-chlorophenylsulfonamido)-.

Aniline, n,n-dimethyl-p-(p-tolylsulfonamido)-.

Find more compounds similar to 4-amino-N-(4-nitrophenyl)benzenesulfonamide.

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Chemical Properties of 4-amino-N-(4-nitrophenyl)benzenesulfonamide

Physical Properties

Temperature Dependent Properties

Similar Compounds

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