6-(4-Cyanophenyl)nicotinic acid
[CAS# 648898-18-4]

Identification

• Name: 6-(4-Cyanophenyl)nicotinic acid
• Synonyms: 3-Pyridinecarboxylic acid, 6-(4-cyanophenyl)-; 6-(4-Cyanophenyl)nicotinic acid; 6-(4-Cyanphenyl)nicotinsäure
• Molecular Formula: C₁₃H₈N₂O₂
• Molecular Weight: 224.21
• CAS Registry Number: 648898-18-4
• SMILES: c1cc(ccc1C#N)c2ccc(cn2)C(=O)O
• InChI: 1S/C13H8N2O2/c14-7-9-1-3-10(4-2-9)12-6-5-11(8-15-12)13(16)17/h1-6,8H,(H,16,17)
• InChIKey: BTIDMWGKJCRQDZ-UHFFFAOYSA-N

Properties

• Density: 1.4±0.1g/cm³ (Cal.)
• Boiling point: 460.0±40.0°C at 760 mmHg (Cal.)
• Flash point: 232.0±27.3°C (Cal.)
• Refractive index: 1.656 (Cal.)