Vitas-M small molecule compound

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

Catalog ID
STK915478
SMILES Clc1ccccc1OC(=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 C11H8BrClN2O2 MW 315.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H8BrClN2O2/c1-15-10(7(12)6-14-15)11(16)17-9-5-3-2-4-8(9)13/h2-6H,1H3
InChIKey
KRMJMZCAGNJGRB-UHFFFAOYSA-N
Synonyms
514816-24-1
(2CHLOROPHENYL)4BROMO2METHYLPYRAZOLE3CARBOXYLATE
2chlorophenyl4bromo1methyl1Hpyrazole5carboxylate
2CHLOROPHENYL4BROMO1METHYLPYRAZOLE5CARBOXYLATE
514816241
CN1C(=C(C=N1)Br)C(=O)OC2=CC=CC=C2Cl
InChI=1SC11H8BrClN2O2c11510(7(12)61415)11(16)17953248(9)13h26H1H3
MFCD02175112
ZINC000000467476
ZINC00467476
ZINC467476

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Available files

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