[3-(4-Chlorophenyl)-1,2-Oxazol-5-Yl]Methanol
[CAS# 206055-90-5]

Identification

• Name: [3-(4-Chlorophenyl)-1,2-Oxazol-5-Yl]Methanol
• Synonyms: (3-(4-chlorophenyl)isoxazol-5-yl)methanol; [3-(4-Chlorophenyl)-5-isoxazolyl]methanol; [3-(4-chlorophenyl)isoxazol-5-yl]methan-1-ol
• Molecular Formula: C₁₀H₈ClNO₂
• Molecular Weight: 209.63
• CAS Registry Number: 206055-90-5
• SMILES: C1=CC(=CC=C1C2=NOC(=C2)CO)Cl
• InChI: 1S/C10H8ClNO2/c11-8-3-1-7(2-4-8)10-5-9(6-13)14-12-10/h1-5,13H,6H2
• InChIKey: YJIXYDFXXAWEMH-UHFFFAOYSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Melting point: 98-100°C (Expl.)
• Boiling point: 389.2±32.0°C at 760 mmHg (Cal.)
• Flash point: 189.2±25.1°C (Cal.)
• Refractive index: 1.587 (Cal.)

Safety Data

• Safety Description: IRRITANT

References

• (1): L.-D. Tang, D.-T. Zhang, F.-G. Sun, G.-Y. Duan and J.-W. Wang. [3-(4-Chlorophenyl)isoxazol-5-yl]methanol, Acta Cryst. (2006). E62, o1298-o1299