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Product Overview

Product Code

TRC-S143500

CAS Number

361442-04-8

Product Format

Neat

Molecular Formula

C18 H25 N3 O2

Molecular Weight

315.41

API Family

Saxagliptin

Product Categories

TRC, Pharmaceutical Toxicology Reference Materials , API Reference Standards & Research Materials

Product Type

API, Synthesis tool

Purity

>95% (HPLC)

Documentation

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Product Information

Chemical Data

Analyte Name

Saxagliptin

CAS Number

361442-04-8

Molecular Formula

C18 H25 N3 O2

Molecular Weight

315.41

Accurate Mass

315.1947

SMILES

N[C@H](C(=O)N1[C@@H](C[C@@H]2C[C@H]12)C#N)C34CC5CC(CC(O)(C5)C3)C4

InChI

InChI=1S/C18H25N3O2/c19-8-13-2-12-3-14(12)21(13)16(22)15(20)17-4-10-1-11(5-17)7-18(23,6-10)9-17/h10-15,23H,1-7,9,20H2/t10?,11?,12-,13+,14+,15-,17?,18?/m1/s1

IUPAC

(1S,3S,5S)-2-[(2S)-2-amino-2-(3-hydroxy-1-adamantyl)acetyl]-2-azabicyclo[3.1.0]hexane-3-carbonitrile

Product Data

Storage Temperature

-20°C

Shipping Temperature

Blue Ice

Country of Origin

CANADA

Product Format

Neat

API Family

Saxagliptin

Purity

>95% (HPLC)

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