3-(3-Dimethylamino-Propyl)-4-Oxo-10-Oxa-3-Aza-Tricyclo[5.2.1.0(1,5)]Dec-8-Ene-6-Carboxylic Acid
[CAS# 436811-03-9]

Identification

• Name: 3-(3-Dimethylamino-Propyl)-4-Oxo-10-Oxa-3-Aza-Tricyclo[5.2.1.0(1,5)]Dec-8-Ene-6-Carboxylic Acid
• Molecular Formula: C₁₄H₂₀N₂O₄
• Molecular Weight: 280.32
• CAS Registry Number: 436811-03-9
• SMILES: [C@@H]13[C@]2(O[C@@H]([C@@H]1C([O-])=O)C=C2)CN(C3=O)CCC[NH+](C)C
• InChI: 1S/C14H20N2O4/c1-15(2)6-3-7-16-8-14-5-4-9(20-14)10(13(18)19)11(14)12(16)17/h4-5,9-11H,3,6-8H2,1-2H3,(H,18,19)/t9-,10+,11-,14-/m1/s1
• InChIKey: LQPOKYQPPSTSHV-FBKDDSFISA-N

Properties

• Density: 1.338g/cm³ (Cal.)
• Boiling point: 493.22°C at 760 mmHg (Cal.)
• Flash point: 252.091°C (Cal.)