3-{5-[(E)-(3-Methyl-5-oxo-1,2-oxazol-4(5H)-ylidene)methyl]-2-furyl}benzoic acid
[CAS# 884497-55-6]

Identification

• Name: 3-{5-[(E)-(3-Methyl-5-oxo-1,2-oxazol-4(5H)-ylidene)methyl]-2-furyl}benzoic acid
• Synonyms: 3-{5-[(E)-(3-methyl-5-oxoisoxazol-4(5H)-ylidene)methyl]-2-furyl}benzoic acid; MFCD02786269
• Molecular Formula: C₁₆H₁₁NO₅
• Molecular Weight: 297.26
• CAS Registry Number: 884497-55-6
• SMILES: O=C(O)c1cccc(c1)c3oc(\C=C/2\C(=O)O\N=C\2C)cc3
• InChI: 1S/C16H11NO5/c1-9-13(16(20)22-17-9)8-12-5-6-14(21-12)10-3-2-4-11(7-10)15(18)19/h2-8H,1H3,(H,18,19)/b13-8+
• InChIKey: LLGRSOQSFREAIM-MDWZMJQESA-N

Properties

• Density: 1.394g/cm³ (Cal.)
• Boiling point: 513.811°C at 760 mmHg (Cal.)
• Flash point: 264.544°C (Cal.)
• Refractive index: 1.64 (Cal.)