Vitas-M small molecule compound
4-bromo-1-(butan-2-yl)-1H-pyrazole-5-carboxylic acid
Catalog ID
STL414494
SMILES CC(n1ncc(c1C(=O)O)Br)CC
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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 C8H11BrN2O2 MW 247.09 g/mol Purity >90% as per NMR
InChI
InChI=1S/C8H11BrN2O2/c1-3-5(2)11-7(8(12)13)6(9)4-10-11/h4-5H,3H2,1-2H3,(H,12,13)InChIKey
RWRDPCXJERHWDR-UHFFFAOYSA-NSynonyms
1006494-01-41006494014
4bromo1(butan2yl)1Hpyrazole5carboxylicacid
4BROMO1(METHYLPROPYL)PYRAZOLE5CARBOXYLICACID
4BROMO1SECBUTYL1HPYRAZOLE5CARBOXYLICACID
4bromo2butan2ylpyrazole3carboxylicacid
CCC(C)N1C(=C(C=N1)Br)C(=O)O
InChI=1SC8H11BrN2O2c135(2)117(8(12)13)6(9)41011h45H3H212H3(H1213)
MFCD06805243
ZINC000020313840
ZINC000020313843
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