3-(4-Fluorophenyl)-5-methyl-1,2-oxazole-4-carbaldehyde
[CAS# 869496-66-2]

Identification

• Name: 3-(4-Fluorophenyl)-5-methyl-1,2-oxazole-4-carbaldehyde
• Synonyms: 3- -5-methylisoxazole-4-carboxaldehyde; 3-(4-Fluorophenyl)-5-methylisoxazole-4-carboxaldehyde
• Molecular Formula: C₁₁H₈FNO₂
• Molecular Weight: 205.19
• CAS Registry Number: 869496-66-2
• SMILES: CC1=C(C(=NO1)C2=CC=C(C=C2)F)C=O
• InChI: 1S/C11H8FNO2/c1-7-10(6-14)11(13-15-7)8-2-4-9(12)5-3-8/h2-6H,1H3
• InChIKey: GKFSKVZRERHBQP-UHFFFAOYSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Melting point: 97-100°C (Expl.)
• Boiling point: 356.5±42.0°C at 760 mmHg (Cal.)
• Flash point: 169.4±27.9°C (Cal.)
• Refractive index: 1.562 (Cal.)

Safety Data

• Safety Code: S26;S37
• Risk Code: R36/37/38
• Hazard Symbol: X
• Safety Description: WARNING: Irritates lungs, eyes, skin