(4-Benzyl-1-Oxo-2(1H)-Phthalazinyl)Acetic Acid
[CAS# 114897-85-7]

Identification

• Name: (4-Benzyl-1-Oxo-2(1H)-Phthalazinyl)Acetic Acid
• Synonyms: (4-Benzyl-1-oxo-1 H -phthalazin-2-yl)-acetic acid; (4-Benzyl-1-oxo-1H-phthalazin-2-yl)acetic acid; (4-Benzyl-1-Oxo-1H-Phthalazin-2-Yl)-Acetic Acid
• Molecular Formula: C₁₇H₁₄N₂O₃
• Molecular Weight: 294.30
• CAS Registry Number: 114897-85-7
• SMILES: C1=CC=C(C=C1)CC2=NN(C(=O)C3=CC=CC=C32)CC(=O)O
• InChI: 1S/C17H14N2O3/c20-16(21)11-19-17(22)14-9-5-4-8-13(14)15(18-19)10-12-6-2-1-3-7-12/h1-9H,10-11H2,(H,20,21)
• InChIKey: QAGXMQKMEDEMJM-UHFFFAOYSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 534.3±60.0°C at 760 mmHg (Cal.)
• Flash point: 277.0±32.9°C (Cal.)
• Refractive index: 1.646 (Cal.)

Safety Data

• Safety Description: IRRITANT