4-(4-Oxo-3(4H)-Quinazolinyl)Butanoic Acid
[CAS# 25818-89-7]

Identification

• Name: 4-(4-Oxo-3(4H)-Quinazolinyl)Butanoic Acid
• Synonyms: 4-(4-oxo-3-hydroquinazolin-3-yl)butanoic acid; 4-(4-Oxo-4H-quinazolin-3-yl)-butyric acid; 4-(4-OXOQUINAZOLIN-3(4H)-YL)BUTANOICACID
• Molecular Formula: C₁₂H₁₂N₂O₃
• Molecular Weight: 232.24
• CAS Registry Number: 25818-89-7
• SMILES: c1ccc2c(c1)c(=O)n(cn2)CCCC(=O)O
• InChI: 1S/C12H12N2O3/c15-11(16)6-3-7-14-8-13-10-5-2-1-4-9(10)12(14)17/h1-2,4-5,8H,3,6-7H2,(H,15,16)
• InChIKey: YDSMKDAFGDSYPS-UHFFFAOYSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 470.4±47.0°C at 760 mmHg (Cal.)
• Flash point: 238.3±29.3°C (Cal.)
• Refractive index: 1.626 (Cal.)

Safety Data

• Safety Description: IRRITANT