Name: 9-Chloro-6-cyclopropyl-2,2-difluoro-4-oxo-8-(piperazin-1-yl)-4,6-dihydro-2H-[1,3,2]dioxaborinino[5,4-c]quinolin-1-ium-2-uide
Brand: TRC
SKU: TRC-C363440

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Product Overview

Product Code

TRC-C363440

Product Format

Neat

Molecular Formula

C17 H17 B Cl F2 N3 O3

Molecular Weight

395.596

Product Categories

TRC, Pharmaceutical Toxicology Reference Materials

Product Information

Analyte Name

9-Chloro-6-cyclopropyl-2,2-difluoro-4-oxo-8-(piperazin-1-yl)-4,6-dihydro-2H-[1,3,2]dioxaborinino[5,4-c]quinolin-1-ium-2-uide

Molecular Formula

C17 H17 B Cl F2 N3 O3

Molecular Weight

395.596

Accurate Mass

395.102

SMILES

F[B]1(F)OC(=O)C2=CN(C3CC3)c4cc(N5CCNCC5)c(Cl)cc4C2=[O]1

InChI

InChI=1S/C17H17BClF2N3O3/c19-13-7-11-14(8-15(13)23-5-3-22-4-6-23)24(10-1-2-10)9-12-16(11)26-18(20,21)27-17(12)25/h7-10,22H,1-6H2

IUPAC

13-chloro-9-cyclopropyl-4,4-difluoro-12-piperazin-1-yl-3?3,5-dioxa-9-aza-4?4-boratricyclo[8.4.0.02,7]tetradeca-1(10),2,7,11,13-pentaen-6-one

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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9-Chloro-6-cyclopropyl-2,2-difluoro-4-oxo-8-(piperazin-1-yl)-4,6-dihydro-2H-[1,3,2]dioxaborinino[5,4-c]quinolin-1-ium-2-uide

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