3-[(1E)-3,3-Dimethyl-1-triazen-1-yl]isonicotinic acid
[CAS# 93772-12-4]

Identification

• Name: 3-[(1E)-3,3-Dimethyl-1-triazen-1-yl]isonicotinic acid
• Synonyms: (E)-3-(3,3-dimethyltriaz-1-en-1-yl)isonicotinic acid
• Molecular Formula: C₈H₁₀N₄O₂
• Molecular Weight: 194.19
• CAS Registry Number: 93772-12-4
• SMILES: O=C(O)c1ccncc1/N=N/N(C)C
• InChI: 1S/C8H10N4O2/c1-12(2)11-10-7-5-9-4-3-6(7)8(13)14/h3-5H,1-2H3,(H,13,14)/b11-10+
• InChIKey: SHTFSDUMVMLAIO-ZHACJKMWSA-N

Properties

• Density: 1.289g/cm³ (Cal.)
• Boiling point: 422.542°C at 760 mmHg (Cal.)
• Flash point: 209.346°C (Cal.)