4-Butyl-4-Azatricyclo[5.2.1.0^2,6]Dec-8-Ene-3,5-Dione
[CAS# 5436-80-6]

Identification

• Name: 4-Butyl-4-Azatricyclo[5.2.1.0^2,6]Dec-8-Ene-3,5-Dione
• Synonyms: 2-BUTYL-3A,4,7,7A-TETRAHYDRO-1H-4,7-METHANOISOINDOLE-1,3(2H)-DIONE; NSC14525
• Molecular Formula: C₁₃H₁₇NO₂
• Molecular Weight: 219.28
• CAS Registry Number: 5436-80-6
• SMILES: O=C2N(C(=O)C3C1/C=C\C(C1)C23)CCCC
• InChI: 1S/C13H17NO2/c1-2-3-6-14-12(15)10-8-4-5-9(7-8)11(10)13(14)16/h4-5,8-11H,2-3,6-7H2,1H3
• InChIKey: MYVFYVDFTPQNBY-UHFFFAOYSA-N

Properties

• Density: 1.17g/cm³ (Cal.)
• Boiling point: 360.163°C at 760 mmHg (Cal.)
• Flash point: 160.146°C (Cal.)