5-(6-Hydroxy-2,5,7,8-Tetramethyl-Chroman-2-Yl)-2-Methyl-Pentanoic Acid Methyl Ester
[CAS# 7047-69-0]

Identification

• Name: 5-(6-Hydroxy-2,5,7,8-Tetramethyl-Chroman-2-Yl)-2-Methyl-Pentanoic Acid Methyl Ester
• Synonyms: N-(4-Fluorophenyl)-2-Oxo-7-Propoxy-Chromene-3-Carboxamide; N-(4-Fluorophenyl)-2-Oxo-7-Propoxy-3-Chromenecarboxamide; N-(4-Fluorophenyl)-2-Keto-7-Propoxy-Chromene-3-Carboxamide
• Molecular Formula: C₁₉H₁₆FNO₄
• Molecular Weight: 341.34
• CAS Registry Number: 7047-69-0
• SMILES: C3=CC1=C(OC(C(=C1)C(=O)NC2=CC=C(C=C2)F)=O)C=C3OCCC
• InChI: 1S/C19H16FNO4/c1-2-9-24-15-8-3-12-10-16(19(23)25-17(12)11-15)18(22)21-14-6-4-13(20)5-7-14/h3-8,10-11H,2,9H2,1H3,(H,21,22)
• InChIKey: JBBHDDXYOYHSSH-UHFFFAOYSA-N

Properties

• Density: 1.339g/cm³ (Cal.)
• Boiling point: 573.08°C at 760 mmHg (Cal.)
• Flash point: 300.388°C (Cal.)