Chemical Properties of Benzamide, 2,5-dichloro-n-cyanomethyl-3-nitro- (CAS 22978-18-3)

InChI

InChI=1S/C9H5Cl2N3O3/c10-5-3-6(9(15)13-2-1-12)8(11)7(4-5)14(16)17/h3-4H,2H2,(H,13,15)

InChI Key

SCHAPWDTKXLDEP-UHFFFAOYSA-N

Formula

C9H5Cl2N3O3

SMILES

N#CCNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1Cl

Molecular Weight¹

274.06

CAS

22978-18-3

• 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	[405.46; 432.96]	J/mol×K	[879.76; 1137.44]
Cp,gas	405.46	J/mol×K	879.76	Joback Calculated Property
Cp,gas	411.70	J/mol×K	922.71	Joback Calculated Property
Cp,gas	417.23	J/mol×K	965.65	Joback Calculated Property
Cp,gas	422.08	J/mol×K	1008.60	Joback Calculated Property
Cp,gas	426.29	J/mol×K	1051.54	Joback Calculated Property
Cp,gas	429.91	J/mol×K	1094.49	Joback Calculated Property
Cp,gas	432.96	J/mol×K	1137.44	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzamide, 2,5-dichloro-n-cyanomethyl-3-nitro-.

Sources

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

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