Dimethyl 1-Butyl-2-Methyl-5-(Phenylmethyl)Pyrrole-3,4-Dicarboxylate
[CAS# 162151-92-0]

Identification

• Name: Dimethyl 1-Butyl-2-Methyl-5-(Phenylmethyl)Pyrrole-3,4-Dicarboxylate
• Synonyms: 1-Butyl-2-Methyl-5-(Phenylmethyl)Pyrrole-3,4-Dicarboxylic Acid Dimethyl Ester; 2-(Benzyl)-1-Butyl-5-Methyl-Pyrrole-3,4-Dicarboxylic Acid Dimethyl Ester; Aids-028417
• Molecular Formula: C₂₀H₂₅NO₄
• Molecular Weight: 343.42
• CAS Registry Number: 162151-92-0
• SMILES: C2=C(CC1=C(C(=C([N]1CCCC)C)C(=O)OC)C(=O)OC)C=CC=C2
• InChI: 1S/C20H25NO4/c1-5-6-12-21-14(2)17(19(22)24-3)18(20(23)25-4)16(21)13-15-10-8-7-9-11-15/h7-11H,5-6,12-13H2,1-4H3
• InChIKey: MSUBZYFZHDXGDW-UHFFFAOYSA-N

Properties

• Density: 1.1g/cm³ (Cal.)
• Boiling point: 459.82°C at 760 mmHg (Cal.)
• Flash point: 231.891°C (Cal.)