2-Benzyloctahydro-4H-isoindol-4-one
[CAS# 879687-90-8]

Identification

• Name: 2-Benzyloctahydro-4H-isoindol-4-one
• Synonyms: 2-benzylhexahydro-1H-isoindol-4(2H)-one; 8-benzyl-8-azabicyclo[4.3.0]nonan-2-one; MFCD10758102
• Molecular Formula: C₁₅H₁₉NO
• Molecular Weight: 229.32
• CAS Registry Number: 879687-90-8
• SMILES: O=C1CCCC2CN(CC12)Cc3ccccc3
• InChI: 1S/C15H19NO/c17-15-8-4-7-13-10-16(11-14(13)15)9-12-5-2-1-3-6-12/h1-3,5-6,13-14H,4,7-11H2
• InChIKey: CEOKBKQHDGSNSQ-UHFFFAOYSA-N

Properties

• Density: 1.11g/cm³ (Cal.)
• Boiling point: 353.114°C at 760 mmHg (Cal.)
• Flash point: 156.82°C (Cal.)
• Refractive index: 1.57 (Cal.)

Safety Data

• Safety Description: IRRITANT