3-methyl-4-morpholin-4-ium-4-yl-2,2-diphenyl-butanoic acid sulfate
[CAS# 93841-21-5]

Identification

• Name: 3-methyl-4-morpholin-4-ium-4-yl-2,2-diphenyl-butanoic acid sulfate
• Synonyms: 4-(3-carboxy-2-methyl-3,3-diphenylpropyl)morpholinium hydrogen sulphate
• Molecular Formula: C₂₁H₂₆NO₇S
• Molecular Weight: 436.50
• CAS Registry Number: 93841-21-5
• EINECS: 298-992-5
• SMILES: CC(C[NH+]1CCOCC1)C(c2ccccc2)(c3ccccc3)C(O)=O.[O-]S([O-])(=O)=O
• InChI: 1S/C21H25NO3.H2O4S/c1-17(16-22-12-14-25-15-13-22)21(20(23)24,18-8-4-2-5-9-18)19-10-6-3-7-11-19;1-5(2,3)4/h2-11,17H,12-16H2,1H3,(H,23,24);(H2,1,2,3,4)/p-1
• InChIKey: OFIQJTJIXKPUGI-UHFFFAOYSA-M

Properties

• Boiling point: 586.1°C at 760 mmHg (Cal.)
• Flash point: 308.3°C (Cal.)