3-Cyano-4-methyl-1-naphthoic acid
[CAS# 827344-68-3]

Identification

• Name: 3-Cyano-4-methyl-1-naphthoic acid
• Synonyms: 3-cyano-4-methyl-1-naphthoic acid
• Molecular Formula: C₁₃H₉NO₂
• Molecular Weight: 211.22
• CAS Registry Number: 827344-68-3
• SMILES: O=C(O)c2c1ccccc1c(c(C#N)c2)C
• InChI: 1S/C13H9NO2/c1-8-9(7-14)6-12(13(15)16)11-5-3-2-4-10(8)11/h2-6H,1H3,(H,15,16)
• InChIKey: PEXDTAQQTZSLDT-UHFFFAOYSA-N

Properties

• Density: 1.313g/cm³ (Cal.)
• Boiling point: 448.523°C at 760 mmHg (Cal.)
• Flash point: 225.059°C (Cal.)
• Refractive index: 1.665 (Cal.)