Chemical Properties of Benzenesulfonamide, N-butyl- (CAS 3622-84-2)

InChI

InChI=1S/C10H15NO2S/c1-2-3-9-11-14(12,13)10-7-5-4-6-8-10/h4-8,11H,2-3,9H2,1H3

InChI Key

IPRJXAGUEGOFGG-UHFFFAOYSA-N

Formula

C10H15NO2S

SMILES

CCCCNS(=O)(=O)c1ccccc1

Molecular Weight¹

213.30

CAS

3622-84-2

Other Names

• Benzenesulfonic acid butyl amide
• N-Butylbenzenesulfonamide
• Plastomoll BMB
• N-(n-Butyl)benzenesulfonamide
• Dellatol BBS
• Plasthall BSA
• Uniplex 214
• BM 4 (sulfonamide)
• Cetamoll BMB
• NSC 3536
• N-butylbenzenesulphonamide

• 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).
• I_np : Non-polar retention indices.
• I : Polar retention indices.
• 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

Property	Value	Unit	Source
ΔfG°	-233.42	kJ/mol	Joback Calculated Property
ΔfH°gas	-413.08	kJ/mol	Joback Calculated Property
ΔfusH°	32.17	kJ/mol	Joback Calculated Property
ΔvapH°	65.20	kJ/mol	Joback Calculated Property
log10WS	-2.60		Crippen Calculated Property
logPoct/wat	1.765		Crippen Calculated Property
McVol	166.070	ml/mol	McGowan Calculated Property
Pc	3547.31	kPa	Joback Calculated Property
Inp	[1794.00; 1797.00]
Inp	1794.00		NIST
Inp	1797.00		NIST
I	2956.00		NIST
Tboil	552.83	K	Joback Calculated Property
Tc	752.37	K	Joback Calculated Property
Tfus	320.10	K	Joback Calculated Property
Vc	0.648	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[386.59; 464.61]	J/mol×K	[552.83; 752.37]
Cp,gas	386.59	J/mol×K	552.83	Joback Calculated Property
Cp,gas	401.71	J/mol×K	586.09	Joback Calculated Property
Cp,gas	415.96	J/mol×K	619.34	Joback Calculated Property
Cp,gas	429.35	J/mol×K	652.60	Joback Calculated Property
Cp,gas	441.92	J/mol×K	685.86	Joback Calculated Property
Cp,gas	453.66	J/mol×K	719.12	Joback Calculated Property
Cp,gas	464.61	J/mol×K	752.37	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzenesulfonamide, N-butyl-.

Sources

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

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