Actifed
[CAS# 8054-27-1]

Identification

• Name: Actifed
• Synonyms: (1S,2S)-2-Methylamino-1-Phenyl-Propan-1-Ol; 2-[(E)-1-(P-Tolyl)-3-Pyrrolidin-1-Yl-Prop-1-Enyl]Pyridine; Dihydrochloride; (1S,2S)-2-Methylamino-1-Phenylpropan-1-Ol; 2-[(E)-1-(P-Tolyl)-3-1-Pyrrolidinylprop-1-Enyl]Pyridine; Dihydrochloride
• Molecular Formula: C₂₉H₃₉Cl₂N₃O
• Molecular Weight: 516.55
• CAS Registry Number: 8054-27-1
• SMILES: C1CCN(C1)C\C=C(/C2=CC=C(C=C2)C)C3=CC=CC=N3.[C@@H](NC)([C@@H](O)C4=CC=CC=C4)C.[H+].[H+].[Cl-].[Cl-]
• InChI: 1S/C19H22N2.C10H15NO.2ClH/c1-16-7-9-17(10-8-16)18(19-6-2-3-12-20-19)11-15-21-13-4-5-14-21;1-8(11-2)10(12)9-6-4-3-5-7-9;;/h2-3,6-12H,4-5,13-15H2,1H3;3-8,10-12H,1-2H3;2*1H/b18-11+;;;/t;8-,10+;;/m.0../s1
• InChIKey: CNBCKNGTUYBXON-PLLJCRPXSA-N

Properties

• Boiling point: 435.4°C at 760 mmHg (Cal.)
• Flash point: 217.1°C (Cal.)