Name: rac-Sitagliptin Phosphate
Brand: TRC
SKU: TRC-S491045-1MG

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Product Overview

Product Code

TRC-S491045-1MG

CAS Number

823817-57-8

Product Format

Neat

Molecular Formula

C16H18F6N5O5P

Molecular Weight

505.31

Product Categories

TRC, Enzyme inhibitors, Enzyme inhibitors, API Reference Standards & Research Materials

Product Type

API

Documentation

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Product Information

Chemical Data

Analyte Name

rac-Sitagliptin Phosphate

CAS Number

823817-57-8

Molecular Formula

C16H18F6N5O5P

Molecular Weight

505.31

Accurate Mass

505.095

SMILES

O=P(OO)=O.FC1=CC(CC(N)CC(N2CCN3C(C2)=NN=C3C(F)(F)F)=O)=C(F)C=C1F.[HH]

InChI

InChI=1S/C16H15F6N5O.H3O4P/c17-10-6-12(19)11(18)4-8(10)3-9(23)5-14(28)26-1-2-27-13(7-26)24-25-15(27)16(20,21)22;1-5(2,3)4/h4,6,9H,1-3,5,7,23H2;(H3,1,2,3,4)

IUPAC

3-amino-1-[3-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl]-4-(2,4,5-trifluorophenyl)butan-1-one;phosphoric acid

Product Data

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

API

Product Format

Neat

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