Buquinolate
[CAS# 5486-03-3]

Identification

• Classification: Analytical chemistry >> Standard >> Forensic and veterinary standards
• Name: Buquinolate
• Synonyms: Ethyl 6,7-Diisobutoxy-4-Oxo-1H-Quinoline-3-Carboxylate; 6,7-Diisobutoxy-4-Oxo-1H-Quinoline-3-Carboxylic Acid Ethyl Ester; 6,7-Diisobutoxy-4-Keto-1H-Quinoline-3-Carboxylic Acid Ethyl Ester
• Molecular Formula: C₂₀H₂₇NO₅
• Molecular Weight: 361.44
• CAS Registry Number: 5486-03-3
• EINECS: 226-814-8
• SMILES: C1=C(C(=CC2=C1NC=C(C(OCC)=O)C2=O)OCC(C)C)OCC(C)C
• InChI: 1S/C20H27NO5/c1-6-24-20(23)15-9-21-16-8-18(26-11-13(4)5)17(25-10-12(2)3)7-14(16)19(15)22/h7-9,12-13H,6,10-11H2,1-5H3,(H,21,22)
• InChIKey: LVVXOXRUTDAKFE-UHFFFAOYSA-N

Properties

• Density: 1.1±0.1g/cm³ (Cal.)
• Boiling point: 460.8±40.0°C at 760 mmHg (Cal.)
• Flash point: 232.5±27.3°C (Cal.)