N-Boc-Sitagliptin
[CAS# 486460-23-5]

Identification

• Name: N-Boc-Sitagliptin
• Synonyms: tert-butyl N-[(2R)-4-oxo-4-[3-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl]-1-(2,4,5-trifluorophenyl)butan-2-yl]carbamate
• Molecular Formula: C₂₁H₂₃F₆N₅O₃
• Molecular Weight: 507.43
• CAS Registry Number: 486460-23-5
• SMILES: CC(C)(C)OC(=O)N[C@H](CC1=CC(=C(C=C1F)F)F)CC(=O)N2CCN3C(=NN=C3C(F)(F)F)C2

Properties

• Density: 1.5±0.1 g/cm³, Calc.^*
• Index of Refraction: 1.556, Calc.^*

^* Calculated using Advanced Chemistry Development (ACD/Labs) Software.

Safety Data

• Hazard Symbols: GHS07;GHS08 Warning
• Risk Statements: H302-H315-H319-H335-H373-H412
• Safety Statements: P260-P264-P270-P271-P273-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501