Vitas-M small molecule compound

1,4-bis(1H-benzotriazol-1-yl)butane-1,4-dione

Catalog ID
STK441590
SMILES O=C(n1nnc2c1cccc2)CCC(=O)n1nnc2c1cccc2

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C16H12N6O2 MW 320.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12N6O2/c23-15(21-13-7-3-1-5-11(13)17-19-21)9-10-16(24)22-14-8-4-2-6-12(14)18-20-22/h1-8H,9-10H2
InChIKey
MSVSFPUSNSUDFC-UHFFFAOYSA-N
Synonyms

11SUCCINYLBIS(1HBENZOTRIAZOLE)
14bis(1Hbenzotriazol1yl)butane14dione
14BIS(BENZOTRIAZOL1YL)BUTANE14DIONE
14DIBENZOTRIAZOLYLBUTANE14DIONE
C1=CC=C2C(=C1)N=NN2C(=O)CCC(=O)N3C4=CC=CC=C4N=N3
InChI=1SC16H12N6O2c2315(2113731511(13)171921)91016(24)2214842612(14)182022h18H910H2
MFCD03401048
ZINC000004904885
ZINC04904885
ZINC4904885

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.