Description:
(S)-Sitagliptin N-Boc-Acid Impurity is an impurity of Sitagliptin. Sitagliptin is a dipeptidyl peptidase-4 (DPP-4) inhibitor for treatment of diabetes mellitus type 2.
- Molecular Weight: 333.3
- Molecular Formula: C15H18F3NO4
Purity: >95%
Canonical SMILES:
CC(C)(C)OC(=O)NC(CC1=CC(=C(C=C1F)F)F)CC(=O)O
InChI:
InChI=1S/C15H18F3NO4/c1-15(2,3)23-14(22)19-9(6-13(20)21)4-8-5-11(17)12(18)7-10(8)16/h5,7,9H,4,6H2,1-3H3,(H,19,22)(H,20,21)/t9-/m0/s1
InChIKey: TUAXCHGULMWHIO-VIFPVBQESA-N
- Boiling Point: 443.1°C at 760 mmHg
- Melting Point: 123-125°C
- Solubility: Soluble in DMSO, Methanol
- Appearance: White to Off-white Solid
- Storage: Store at 2-8°C
Synonyms:
Sitagliptin Impurity 41; Boc-(S)-3-Amino-4-(2,4,5-trifluorophenyl)butyric Acid; (βS)-β-[[(1,1-Dimethylethoxy)carbonyl]amino]-2,4,5-trifluoro-benzenebutanoic Acid; (S)-3-((tert-butoxycarbonyl)amino)-4-(2,4,5-trifluorophenyl)butanoic acid
More details are to be found on supplier website
