Vitas-M small molecule compound

methyl 4-bromo-1-methyl-1H-pyrazole-5-carboxylate

Catalog ID
STK315996
SMILES COC(=O)c1c(Br)cnn1C

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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 C6H7BrN2O2 MW 219.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C6H7BrN2O2/c1-9-5(6(10)11-2)4(7)3-8-9/h3H,1-2H3
InChIKey
XOGHZBXSBLBJHQ-UHFFFAOYSA-N
Synonyms
514816-42-3
4BROMO2METHYL2HPYRAZOLE3CARBOXYLICACIDMETHYLESTER
514816423
CN1C(=C(C=N1)Br)C(=O)OC
InChI=1SC6H7BrN2O2c195(6(10)112)4(7)389h3H12H3
methyl4bromo1methyl1Hpyrazole5carboxylate
METHYL4BROMO1METHYLPYRAZOLE5CARBOXYLATE
METHYL4BROMO2METHYLPYRAZOLE3CARBOXYLATE
MFCD01459850
ZINC000000035730
ZINC00035730
ZINC35730

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Available files

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