(1-Methyl-5,6-Dihydro-2H-Pyridin-1-Ium-3-Yl)Methyl 2-Hydroxy-3-Methyl-2-Phenylbutanoate Chloride
[CAS# 101711-01-7]

Identification

• Name: (1-Methyl-5,6-Dihydro-2H-Pyridin-1-Ium-3-Yl)Methyl 2-Hydroxy-3-Methyl-2-Phenylbutanoate Chloride
• Synonyms: (1-Methyl-5,6-Dihydro-2H-Pyridin-1-Ium-3-Yl)Methyl 2-Hydroxy-3-Methyl-2-Phenyl-Butanoate Chloride; 2-Hydroxy-3-Methyl-2-Phenylbutanoic Acid (1-Methyl-5,6-Dihydro-2H-Pyridin-1-Ium-3-Yl)Methyl Ester Chloride; 2-Hydroxy-3-Methyl-2-Phenyl-Butyric Acid (1-Methyl-5,6-Dihydro-2H-Pyridin-1-Ium-3-Yl)Methyl Ester Chloride
• Molecular Formula: C₁₈H₂₆ClNO₃
• Molecular Weight: 339.86
• CAS Registry Number: 101711-01-7
• SMILES: C2=C(C(O)(C(C)C)C(OCC1=CCC[NH+](C1)C)=O)C=CC=C2.[Cl-]
• InChI: 1S/C18H25NO3.ClH/c1-14(2)18(21,16-9-5-4-6-10-16)17(20)22-13-15-8-7-11-19(3)12-15;/h4-6,8-10,14,21H,7,11-13H2,1-3H3;1H
• InChIKey: PRIXSTVGPLZOTP-UHFFFAOYSA-N

Properties

• Boiling point: 429.3°C at 760 mmHg (Cal.)
• Flash point: 213.4°C (Cal.)