Chemical Properties of Chlornidine (CAS 26389-78-6)

InChI

InChI=1S/C11H13Cl2N3O4/c1-8-6-9(15(17)18)11(10(7-8)16(19)20)14(4-2-12)5-3-13/h6-7H,2-5H2,1H3

InChI Key

XKUWFOYPQIVFMM-UHFFFAOYSA-N

Formula

C11H13Cl2N3O4

SMILES

Cc1cc([N+](=O)[O-])c(N(CCCl)CCCl)c([N+](=O)[O-])c1

Molecular Weight¹

322.14

CAS

26389-78-6

Other Names

• Benzenamine, N,N-bis(2-chloroethyl)-4-methyl-2,6-dinitro-
• p-Toluidine, N,N-bis(2-chloroethyl)-2,6-dinitro-
• AN 5647
• AN 56477
• Torpedo

• 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	[580.39; 628.75]	J/mol×K	[883.68; 1134.07]
Cp,gas	580.39	J/mol×K	883.68	Joback Calculated Property
Cp,gas	590.43	J/mol×K	925.41	Joback Calculated Property
Cp,gas	599.59	J/mol×K	967.14	Joback Calculated Property
Cp,gas	607.92	J/mol×K	1008.88	Joback Calculated Property
Cp,gas	615.51	J/mol×K	1050.61	Joback Calculated Property
Cp,gas	622.43	J/mol×K	1092.34	Joback Calculated Property
Cp,gas	628.75	J/mol×K	1134.07	Joback Calculated Property

Similar Compounds

Find more compounds similar to Chlornidine.

Sources

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

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