Chemical Properties of 5-Methyl-N-nitro-1H-1,2,4-triazol-3-amine (CAS 42216-41-1)

InChI

InChI=1S/C3H5N5O2/c1-2-4-3(6-5-2)7-8(9)10/h1H3,(H2,4,5,6,7)

InChI Key

AKRHSQIJWHJWPC-UHFFFAOYSA-N

Formula

C3H5N5O2

SMILES

Cc1n[nH]c(N[N+](=O)[O-])n1

Molecular Weight¹

143.10

CAS

42216-41-1

Other Names

• 1H-1,2,4-Triazol-3-amine, 5-methyl-N-nitro-
• 3-Methyl-5-nitroamino-1,2,4-triazone
• 3-Methyl-5-nitroamino-1,2,4-triazole

• ω : Acentric Factor.
• Δ_cH°_solid : Standard solid enthalpy of combustion (kJ/mol).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fH°_solid : Solid phase 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.
• 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

Similar Compounds

Find more compounds similar to 5-Methyl-N-nitro-1H-1,2,4-triazol-3-amine.

Sources

• Cheméo Relay (1.0)
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• Crippen Method
• Crippen Method
• McGowan Method
• NIST Webbook

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