Vildagliptin Carboxy Acid Metabolite Trifluoroacetate

Base Information

• Chemical Name: Vildagliptin Carboxy Acid Metabolite Trifluoroacetate
• CAS No.: 565453-41-0
• Molecular Formula: C19H27F3N2O6
• Molecular Weight: 436.4
• Mol file: 565453-41-0.mol

Synonyms:565453-41-0;Vildagliptin Carboxy Acid Metabolite Trifluoroacetate;(2S)-1-[2-[(3-Hydroxy-1-adamantyl)amino]acetyl]pyrrolidine-2-carboxylic acid;2,2,2-trifluoroacetic acid;AKOS040754851;PD063964;Vildagliptin carboxylic acid metabolite (trifluoroacetate salt)

Chemical Property of Vildagliptin Carboxy Acid Metabolite Trifluoroacetate

Chemical Property:

• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 4
• Exact Mass: 436.18212107
• Heavy Atom Count: 30
• Complexity: 604

Purity/Quality:

95% ^*data from raw suppliers

Vildagliptin carboxylic acid metabolite (trifluoroacetate salt) ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1CC(N(C1)C(=O)CNC23CC4CC(C2)CC(C4)(C3)O)C(=O)O.C(=O)(C(F)(F)F)O
• Isomeric SMILES: C1C[C@H](N(C1)C(=O)CNC23CC4CC(C2)CC(C4)(C3)O)C(=O)O.C(=O)(C(F)(F)F)O

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