N'-(2,2-Dimethylpropanoyl)Isonicotinohydrazide
[CAS 303796-04-5]

Identification

• Name: N'-(2,2-Dimethylpropanoyl)Isonicotinohydrazide
• Synonyms: 2,2-dimethyl-N-(4-pyridylcarbonylamino)propanamide; Isonicotinic acid N-(2,2-dimethyl-propanoyl)-hydrazide; N'-(2,2-dimethylpropanoyl)pyridine-4-carbohydrazide
• Molecular Formula: C₁₁H₁₅N₃O₂
• Molecular Weight: 221.26
• CAS Registry Number: 303796-04-5
• SMILES: CC(C)(C)C(=O)NNC(=O)c1ccncc1
• InChI: 1S/C11H15N3O2/c1-11(2,3)10(16)14-13-9(15)8-4-6-12-7-5-8/h4-7H,1-3H3,(H,13,15)(H,14,16)
• InChIKey: OXSWEYOULJYQNX-UHFFFAOYSA-N

Properties

• Density: 1.1±0.1g/cm³ (Cal.)
• Boiling point: 447.7±27.0°C at 760 mmHg (Cal.)
• Flash point: 224.6±23.7°C (Cal.)
• Refractive index: 1.528 (Cal.)

References

• (1): Philip Prathipati, Ngai Ling Ma* and Thomas H. Keller. Global Bayesian Models for the Prioritization of Antitubercular Agents, J. Chem. Inf. Model., 2008, 48 (12), pp 2362–2370