Atropine O-(Hydrogen Sulphate)
[CAS# 5226-98-2]

Identification

• Name: Atropine O-(Hydrogen Sulphate)
• Synonyms: (8-Methyl-8-Azabicyclo[3.2.1]Octan-3-Yl) 2-Phenyl-3-Sulfooxy-Propanoate; 2-Phenyl-3-Sulfooxypropanoic Acid (8-Methyl-8-Azabicyclo[3.2.1]Octan-3-Yl) Ester; 2-Phenyl-3-Sulfoxy-Propionic Acid (8-Methyl-8-Azabicyclo[3.2.1]Octan-3-Yl) Ester
• Molecular Formula: C₁₇H₂₃NO₆S
• Molecular Weight: 369.43
• CAS Registry Number: 5226-98-2
• EINECS: 226-026-4
• SMILES: C1(CC2N(C(C1)CC2)C)OC(C(CO[S](O)(=O)=O)C3=CC=CC=C3)=O
• InChI: 1S/C17H23NO6S/c1-18-13-7-8-14(18)10-15(9-13)24-17(19)16(11-23-25(20,21)22)12-5-3-2-4-6-12/h2-6,13-16H,7-11H2,1H3,(H,20,21,22)
• InChIKey: GMLBHJMTVBLXLJ-UHFFFAOYSA-N

Properties

• Density: 1.38g/cm³ (Cal.)