Orpanoxin
[CAS# 60653-25-0]

Identification

• Name: Orpanoxin
• Synonyms: 3-[5-(4-Chlorophenyl)-2-Furyl]-3-Hydroxy-Propanoic Acid; 3-[5-(4-Chlorophenyl)-2-Furyl]-3-Hydroxypropanoic Acid; 3-[5-(4-Chlorophenyl)-2-Furyl]-3-Hydroxy-Propionic Acid
• Molecular Formula: C₁₃H₁₁ClO₄
• Molecular Weight: 266.68
• CAS Registry Number: 60653-25-0
• SMILES: C2=C(C1=CC=C(C=C1)Cl)OC(=C2)C(CC(O)=O)O
• InChI: 1S/C13H11ClO4/c14-9-3-1-8(2-4-9)11-5-6-12(18-11)10(15)7-13(16)17/h1-6,10,15H,7H2,(H,16,17)
• InChIKey: YLJRTDTWWRXOFG-UHFFFAOYSA-N

Properties

• Density: 1.391g/cm³ (Cal.)
• Boiling point: 429.15°C at 760 mmHg (Cal.)
• Flash point: 213.342°C (Cal.)