Quadazocine
[CAS# 69924-29-4]

Identification

• Name: Quadazocine
• Synonyms: Win 44,441; Win 44441; 3-Pentanone, 1-Cyclopentyl-5-(1,2,3,4,5,6-Hexahydro-8-Hydroxy-3,6,11-Trimethyl-2,6-Methano-3-Benzazocin-11-Yl)-, (2Alpha,6Alpha,11S*)- (+-)-
• Molecular Formula: C₂₅H₃₇NO₂
• Molecular Weight: 383.57
• CAS Registry Number: 69924-29-4
• SMILES: [C@@]12(C([C@H](N(CC1)C)CC3=CC=C(O)C=C23)(CCC(=O)CCC4CCCC4)C)C
• InChI: 1S/C25H37NO2/c1-24-14-15-26(3)23(16-19-9-11-21(28)17-22(19)24)25(24,2)13-12-20(27)10-8-18-6-4-5-7-18/h9,11,17-18,23,28H,4-8,10,12-16H2,1-3H3/t23-,24+,25?/m1/s1
• InChIKey: LOYWOYCPSWPKFH-CSIQULDISA-N

Properties

• Density: 1.059g/cm³ (Cal.)
• Boiling point: 514.263°C at 760 mmHg (Cal.)
• Flash point: 264.817°C (Cal.)