3-Isobutyl-5-(2-Methylbutyl)-2H-Pyrrole-2,4(3H)-Dione
[CAS# 496941-92-5]

Identification

• Name: 3-Isobutyl-5-(2-Methylbutyl)-2H-Pyrrole-2,4(3H)-Dione
• Synonyms: 2-(dihydroxymethyl)-2,5-dihydrofuran-2,5-diol
• Molecular Formula: C₁₃H₂₁NO₂
• Molecular Weight: 223.31
• CAS Registry Number: 496941-92-5
• SMILES: CCC(C)CC1=NC(=O)C(C1=O)CC(C)C
• InChI: 1S/C13H21NO2/c1-5-9(4)7-11-12(15)10(6-8(2)3)13(16)14-11/h8-10H,5-7H2,1-4H3
• InChIKey: DEFLUQXFRNCBDI-UHFFFAOYSA-N

Properties

• Density: 1.068g/cm³ (Cal.)
• Boiling point: 305.181°C at 760 mmHg (Cal.)
• Flash point: 124.312°C (Cal.)
• Refractive index: 1.523 (Cal.)