2-Allyl-1,2,3,4,5,6-Hexahydro-1,6-Methano-2-Benzazocine Oxalate
[CAS# 76777-29-2]

Identification

• Name: 2-Allyl-1,2,3,4,5,6-Hexahydro-1,6-Methano-2-Benzazocine Oxalate
• Synonyms: 2-Allyl-1,2,3,4,5,6-Hexahydro-1,6-Methano-2-Benzazocine Oxalate
• Molecular Formula: C₁₇H₂₁NO₄
• Molecular Weight: 303.36
• CAS Registry Number: 76777-29-2
• SMILES: O=C(O)C(=O)O.C1=CC=CC2=C1C3N(CCCC2C3)CC=C
• InChI: 1S/C15H19N.C2H2O4/c1-2-9-16-10-5-6-12-11-15(16)14-8-4-3-7-13(12)14;3-1(4)2(5)6/h2-4,7-8,12,15H,1,5-6,9-11H2;(H,3,4)(H,5,6)
• InChIKey: ZNWBKHREHMOZPR-UHFFFAOYSA-N

Properties

• Boiling point: 304.3°C at 760 mmHg (Cal.)
• Flash point: 125.7°C (Cal.)