m-Toluic Acid 7-Nitro-8-Quinolyl Ester
[CAS# 29007-00-9]

Identification

• Name: m-Toluic Acid 7-Nitro-8-Quinolyl Ester
• Synonyms: (7-Nitro-8-Quinolyl) 3-Methylbenzoate; 3-Methylbenzoic Acid (7-Nitro-8-Quinolyl) Ester; 7-Nitro-8-Quinolyl M-Toluate
• Molecular Formula: C₁₇H₁₂N₂O₄
• Molecular Weight: 308.29
• CAS Registry Number: 29007-00-9
• SMILES: C2=CC1=CC=CN=C1C(=C2[N+]([O-])=O)OC(=O)C3=CC=CC(=C3)C
• InChI: 1S/C17H12N2O4/c1-11-4-2-5-13(10-11)17(20)23-16-14(19(21)22)8-7-12-6-3-9-18-15(12)16/h2-10H,1H3
• InChIKey: SPKSUGVDJKSMRI-UHFFFAOYSA-N

Properties

• Density: 1.35g/cm³ (Cal.)
• Boiling point: 554.358°C at 760 mmHg (Cal.)
• Flash point: 289.066°C (Cal.)