Vitas-M small molecule compound
2-(2-bromo-4-chlorophenoxy)-1-(3,5-dimethyl-1H-pyrazol-1-yl)ethanone
Catalog ID
STL064055
SMILES Clc1ccc(c(c1)Br)OCC(=O)n1nc(cc1C)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 C13H12BrClN2O2 MW 343.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12BrClN2O2/c1-8-5-9(2)17(16-8)13(18)7-19-12-4-3-10(15)6-11(12)14/h3-6H,7H2,1-2H3InChIKey
MDDHNSOTNJCGBQ-UHFFFAOYSA-NSynonyms
2(2bromo4chlorophenoxy)1(35dimethyl1Hpyrazol1yl)ethanone
2(2BROMO4CHLOROPHENOXY)1(35DIMETHYLPYRAZOL1YL)ETHANONE
CC1=CC(=NN1C(=O)COC2=C(C=C(C=C2)Cl)Br)C
InChI=1SC13H12BrClN2O2c1859(2)17(168)13(18)719124310(15)611(12)14h36H7H212H3
MFCD05055156
ZINC000000529152
ZINC00529152
ZINC529152
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