Vitas-M small molecule compound

(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)acetic acid

Catalog ID
STK342531
SMILES OC(=O)Cn1nc(c(c1C)Br)[N+](=O)[O-]

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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 C6H6BrN3O4 MW 264.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C6H6BrN3O4/c1-3-5(7)6(10(13)14)8-9(3)2-4(11)12/h2H2,1H3,(H,11,12)
InChIKey
JUGOZTZNWGFYHL-UHFFFAOYSA-N
Synonyms
345637-67-4
(4BROMO3NITRO5METHYL1HPYRAZOL1YL)ACETICACID
(4bromo5methyl3nitro1Hpyrazol1yl)aceticacid
(4BROMO5METHYL3NITROPYRAZOL1YL)ACETICACID
2(4BROMO5METHYL3NITRO1HPYRAZOL1YL)ACETICACID
2(4BROMO5METHYL3NITROPYRAZOL1YL)ACETICACID
2(4BROMO5METHYL3NITROPYRAZOLYL)ACETICACID
345637674
CC1=C(C(=NN1CC(=O)O)(N+)(=O)(O))Br
InChI=1SC6H6BrN3O4c135(7)6(10(13)14)89(3)24(11)12h2H21H3(H1112)
MFCD00297272
OC(=O)Cn1nc(c(c1C)Br)(N+)(=O)(O)
ZINC000004427208
ZINC4427208

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Available files

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