Vitas-M small molecule compound

5-bromo-1-phenyl-1,5,6,7-tetrahydro-4H-indazol-4-one

Catalog ID
STK771821
SMILES BrC1CCc2c(C1=O)cnn2c1ccccc1

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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 C13H11BrN2O MW 291.15 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11BrN2O/c14-11-6-7-12-10(13(11)17)8-15-16(12)9-4-2-1-3-5-9/h1-5,8,11H,6-7H2
InChIKey
MIYPPKAYULSMQS-UHFFFAOYSA-N
Synonyms

5bromo1phenyl1567tetrahydro4Hindazol4one
5BROMO1PHENYL1H567TRIHYDROINDAZOL4ONE
5BROMO1PHENYL67DIHYDRO5HINDAZOL4ONE
C1CC2=C(C=NN2C3=CC=CC=C3)C(=O)C1Br
InChI=1SC13H11BrN2Oc1411671210(13(11)17)81516(12)9421359h15811H67H2
MFCD03767657
ZINC000000105890
ZINC000000105894

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Available files

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