Vitas-M small molecule compound

4-bromo-3-methyl-5-nitro-1H-pyrazole

Catalog ID
STK301673
SMILES [O-][N+](=O)c1[nH]nc(c1Br)C

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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 C4H4BrN3O2 MW 206.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C4H4BrN3O2/c1-2-3(5)4(7-6-2)8(9)10/h1H3,(H,6,7)
InChIKey
LJUWTSNDTLVFEK-UHFFFAOYSA-N
Synonyms
70951-96-1
(O)(N+)(=O)c1(nH)nc(c1Br)C
4bromo3methyl5nitro1Hpyrazole
4BROMO3METHYL5NITROPYRAZOLE
4BROMO5METHYL3NITRO1HPYRAZOLE
70951961
CC1=C(C(=NN1)(N+)(=O)(O))Br
InChI=1SC4H4BrN3O2c123(5)4(762)8(9)10h1H3(H67)
MFCD01459884
ZINC000001049768
ZINC01049768
ZINC1049768

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Available files

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