Chemical Properties of 4-Chlorobenzenesulfonamide, N-tert.-butyldimethylsilyl-

InChI

InChI=1S/C12H20ClNO2SSi/c1-12(2,3)18(4,5)14-17(15,16)11-8-6-10(13)7-9-11/h6-9,14H,1-5H3

InChI Key

BGCXILOAVPIFIS-UHFFFAOYSA-N

Formula

C12H20ClNO2SSi

SMILES

CC(C)(C)[Si](C)(C)NS(=O)(=O)c1ccc(Cl)cc1

Molecular Weight¹

305.90

• ω : Acentric Factor.
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation 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.
• P_c : Critical Pressure (kPa).
• I_np : Non-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
ω	0.5775		Relay (1.0) Calculated Property
ΔfG°	-49.12	kJ/mol	Relay (1.0-beta) Calculated Property
ΔfH°gas	-476.32	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	87.07	kJ/mol	Relay (1.0) Calculated Property
IE	8.39	eV	Relay (1.0) Calculated Property
log10WS	-3.93		Relay (1.0) Calculated Property
logPoct/wat	3.623		Crippen Calculated Property
Pc	2158.08	kPa	Relay (1.0-beta) Calculated Property
Inp	[2043.00; 2043.00]
Inp	2043.00		NIST
Inp	2043.00		NIST
Tboil	599.73	K	Relay (1.0) Calculated Property
Tc	864.45	K	Relay (1.0) Calculated Property
Tfus	423.78	K	Relay (1.0) Calculated Property
Vc	0.802	m3/kmol	Relay (1.0) Calculated Property

Similar Compounds

Find more compounds similar to 4-Chlorobenzenesulfonamide, N-tert.-butyldimethylsilyl-.

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
• NIST Webbook

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