2-Phenyl-4,5,6,7-Tetrahydro-Isoindole-1,3-Dione
[CAS# 39985-59-6]

Identification

• Name: 2-Phenyl-4,5,6,7-Tetrahydro-Isoindole-1,3-Dione
• Synonyms: 2-Phenyl-4,5,6,7-Tetrahydroisoindole-1,3-Quinone; 4,5,6,7-Tetrahydro-2-Phenyl-1H-Isoindole-1,3(2H)-Dione; Oprea1_658461
• Molecular Formula: C₁₄H₁₃NO₂
• Molecular Weight: 227.26
• CAS Registry Number: 39985-59-6
• SMILES: C1=CC=CC=C1N2C(=O)C3=C(C2=O)CCCC3
• InChI: 1S/C14H13NO2/c16-13-11-8-4-5-9-12(11)14(17)15(13)10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9H2
• InChIKey: QBGQIMOGHUXVKB-UHFFFAOYSA-N

Properties

• Density: 1.28g/cm³ (Cal.)
• Boiling point: 382.254°C at 760 mmHg (Cal.)
• Flash point: 174.681°C (Cal.)