Chemical Properties of Benzenesulfonamide, 3-amino-N-butyl-4-methoxy- (CAS 80-22-8)

InChI

InChI=1S/C11H18N2O3S/c1-3-4-7-13-17(14,15)9-5-6-11(16-2)10(12)8-9/h5-6,8,13H,3-4,7,12H2,1-2H3

InChI Key

XOIMPHNXVTYJAB-UHFFFAOYSA-N

Formula

C11H18N2O3S

SMILES

CCCCNS(=O)(=O)c1ccc(OC)c(N)c1

Molecular Weight¹

258.34

CAS

80-22-8

Other Names

• 3-amino-N-butyl-4-methoxybenzenesulphonamide
• Azoene Fast Red PDC Base
• C.I. 37151
• C.I. Azoic Diazo Component 14
• Fast Ponceau L Base
• Fast Red Base SW
• Fast Red PDC Base
• Fast Red Ponceau L base
• Fast Red SW Base
• Fast Red SW Special Base
• Hiltonil Fast Red PDC Base
• Metanilamide, N1-butyl-4-methoxy-
• N'-Butyl-4-methoxymetanilamide
• N'-n-Butyl-3-amino-4-methoxybenzenesulfonamide
• N1-Butyl-4-methoxymetanilamide
• NSC 50673
• Red PDC Base

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion 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).
• T_boil : Normal Boiling Point Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[524.93; 596.80]	J/mol×K	[680.62; 885.25]
Cp,gas	524.93	J/mol×K	680.62	Joback Calculated Property
Cp,gas	539.18	J/mol×K	714.72	Joback Calculated Property
Cp,gas	552.51	J/mol×K	748.83	Joback Calculated Property
Cp,gas	564.95	J/mol×K	782.93	Joback Calculated Property
Cp,gas	576.47	J/mol×K	817.04	Joback Calculated Property
Cp,gas	587.09	J/mol×K	851.14	Joback Calculated Property
Cp,gas	596.80	J/mol×K	885.25	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzenesulfonamide, 3-amino-N-butyl-4-methoxy-.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
These property values are available through the Cheméo API. A free account gives you an access key.