3,3-Bis[4-(dimethylamino)phenyl]-6-(1-pyrrolidinyl)-2-benzofuran-1(3H)-one
[CAS# 72548-77-7]

Identification

• Name: 3,3-Bis[4-(dimethylamino)phenyl]-6-(1-pyrrolidinyl)-2-benzofuran-1(3H)-one
• Synonyms: 3,3-bis[4-(dimethylamino)phenyl]-6-(1-pyrrolidinyl)phthalide
• Molecular Formula: C₂₈H₃₁N₃O₂
• Molecular Weight: 441.56
• CAS Registry Number: 72548-77-7
• EINECS: 276-714-3
• SMILES: CN(C)c1ccc(cc1)C3(OC(=O)c2cc(ccc23)N4CCCC4)c5ccc(cc5)N(C)C
• InChI: 1S/C28H31N3O2/c1-29(2)22-11-7-20(8-12-22)28(21-9-13-23(14-10-21)30(3)4)26-16-15-24(31-17-5-6-18-31)19-25(26)27(32)33-28/h7-16,19H,5-6,17-18H2,1-4H3
• InChIKey: WGFSNTKSRNEXLZ-UHFFFAOYSA-N

Properties

• Density: 1.215g/cm³ (Cal.)
• Boiling point: 644.993°C at 760 mmHg (Cal.)
• Flash point: 343.879°C (Cal.)