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CS-W001157 4
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(2S)-1-(2-{[(3r)-3-Hydroxyadamantan-1-yl]amino}acetyl)pyrrolidine-2-carboxylic acid; trifluoroacetic acid

  • CAS No. 565453-41-0

  • Cat. No. CS-0165379
  • Purity≥98%
  • MDL No.None

*For research and further manufacturing use only, not for direct human use.

(2S)-1-(2-{[(3r)-3-Hydroxyadamantan-1-yl]amino}acetyl)pyrrolidine-2-carboxylic acid; trifluoroacetic acid|CS-0165379

Structure of 565453-41-0

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General Information

  • CAS No. 565453-41-0
  • Cat. No. CS-0165379
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₉H₂₇F₃N₂O₆
  • Molecular Weight 436.42
  • Synonym(s) Vildagliptin Carboxy Acid Metabolite Trifluoroacetate
  • SMILES OC(C(F)(F)F)=O.O=C(N1[C@@H](CCC1)C(O)=O)CNC23CC4(CC(CC(C4)C3)C2)O

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   96.59
  • LogP   0.28918
  • H_Acceptors   5
  • H_Donors   3
  • Rotatable_Bonds   3

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