Sitagliptin impurity SKY-III

Name: Sitagliptin impurity SKY-III
Brand: 2A Biotech
SKU: 2A-3184721

CAS Number486460-31-5

SynonymsDesfluorositagliptin

Molecular FormulaC16H16F5N5O

Molecular Weight389.32

Density1.56±0.1 g/cm3 (20 ºC 760 Torr)

Cat. No.: 2A-3184721 Purity:

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Quality Control of [ 486460-31-5 ] SDS Specification MoL

Chemical & Physical Properties
CAS Number	486460-31-5
Catalog No.	2A-3184721
Chinese Name	西格列汀杂质 B
Synonyms	Desfluorositagliptin
Molecular Formula	C16H16F5N5O
Molecular Weight	389.32
Density	1.56±0.1 g/cm3 (20 ºC 760 Torr)
Water Solubility	Insuluble (8.2E-3 g/L) (25 ºC)
PubChem ID	14805108
MDL Number	MFCD32898997
SMILES	NC(CC(=O)N1CCn2c(nnc2C(F)(F)F)C1)Cc1cc(F)ccc1F
InChI	InChI=1S/C16H16F5N5O/c17-10-1-2-12(18)9(5-10)6-11(22)7-14(27)25-3-4-26-13(8-25)23-24-15(26)16(19,20)21/h1-2,5,11H,3-4,6-8,22H2/t11-/m1/s1
InChI Key	ABTMQWQGGARRSK-LLVKDONJSA-N
NACRES Code	NA.24
UNSPSC	41116107
Transport Info	Product name: (R)-3-amino-4-(2,5-difluorophenyl)-1-(3-(trifluoromethyl)-5,6-dihydro-[1,2,4]triazole[4,3-a]pyrazin-7(8H-yl)butan-1-one

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