Chemical Properties of N,N-Bis(2-chloroethyl)-p-toluenesulfonamide (CAS 42137-88-2)

InChI

InChI=1S/C11H15Cl2NO2S/c1-10-2-4-11(5-3-10)17(15,16)14(8-6-12)9-7-13/h2-5H,6-9H2,1H3

InChI Key

PTVBBIMKLOMGSY-UHFFFAOYSA-N

Formula

C11H15Cl2NO2S

SMILES

Cc1ccc(S(=O)(=O)N(CCCl)CCCl)cc1

Molecular Weight¹

296.21

CAS

42137-88-2

Other Names

• N,N-Bis(«beta»-chloroethyl)-p-toluenesulfonamide
• Benzenesulfonamide, N,N-bis(2-chloroethyl)-4-methyl-
• N,N-Bis-(2-chloro-ethyl)-4-methyl-benzenesulfonamide
• N,N-bis(2-chloroethyl)-p-toluenesulphonamide

• 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	[477.16; 549.38]	J/mol×K	[617.82; 820.70]
Cp,gas	477.16	J/mol×K	617.82	Joback Calculated Property
Cp,gas	491.44	J/mol×K	651.63	Joback Calculated Property
Cp,gas	504.78	J/mol×K	685.45	Joback Calculated Property
Cp,gas	517.22	J/mol×K	719.26	Joback Calculated Property
Cp,gas	528.78	J/mol×K	753.07	Joback Calculated Property
Cp,gas	539.49	J/mol×K	786.89	Joback Calculated Property
Cp,gas	549.38	J/mol×K	820.70	Joback Calculated Property

Similar Compounds

Find more compounds similar to N,N-Bis(2-chloroethyl)-p-toluenesulfonamide.

Sources

• 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.