(Z)-3-(Isobutylidene)Phthalide
[CAS# 56014-87-0]

Identification

• Name: (Z)-3-(Isobutylidene)Phthalide
• Synonyms: (3E)-3-(2-Methylpropylidene)Isobenzofuran-1-One; (3E)-3-(2-Methylpropylidene)-1-Isobenzofuranone
• Molecular Formula: C₁₂H₁₂O₂
• Molecular Weight: 188.23
• CAS Registry Number: 56014-87-0
• EINECS: 259-945-4
• SMILES: C1=CC=CC2=C1\C(OC2=O)=C/C(C)C
• InChI: 1S/C12H12O2/c1-8(2)7-11-9-5-3-4-6-10(9)12(13)14-11/h3-8H,1-2H3/b11-7+
• InChIKey: LYSNVWBBICAAMS-YRNVUSSQSA-N

Properties

• Density: 1.201g/cm³ (Cal.)
• Boiling point: 304.684°C at 760 mmHg (Cal.)
• Flash point: 124.399°C (Cal.)