Methyl [4-(3-formyl-2,5-dimethyl-1H-pyrrol-1-yl)phenyl]acetate
[CAS# 928708-26-3]

Identification

• Name: Methyl [4-(3-formyl-2,5-dimethyl-1H-pyrrol-1-yl)phenyl]acetate
• Synonyms: [4-(3-Formyl-2,5-dimethyl-pyrrol-1-yl)-phenyl]-acetic acid methyl ester; methyl [4-(3-formyl-2,5-dimethyl-1H-pyrrol-1-yl)phenyl]acetate; methyl 2-(4-(3-formyl-2,5-dimethyl-1H-pyrrol-1-yl)phenyl)acetate
• Molecular Formula: C₁₆H₁₇NO₃
• Molecular Weight: 271.31
• CAS Registry Number: 928708-26-3
• SMILES: COC(=O)Cc1ccc(cc1)n2c(C)c(cc2C)C=O
• InChI: 1S/C16H17NO3/c1-11-8-14(10-18)12(2)17(11)15-6-4-13(5-7-15)9-16(19)20-3/h4-8,10H,9H2,1-3H3
• InChIKey: HXANJYAVBOKAHI-UHFFFAOYSA-N

Properties

• Density: 1.119g/cm³ (Cal.)
• Boiling point: 414.618°C at 760 mmHg (Cal.)
• Flash point: 204.554°C (Cal.)
• Refractive index: 1.553 (Cal.)