Vitas-M small molecule compound
4-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)benzoic acid
Catalog ID
STL197902
SMILES OC(=O)c1ccc(cc1)n1nc(c(c1C)Cl)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 C12H11ClN2O2 MW 250.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H11ClN2O2/c1-7-11(13)8(2)15(14-7)10-5-3-9(4-6-10)12(16)17/h3-6H,1-2H3,(H,16,17)InChIKey
JDRIGXMTCWAPQQ-UHFFFAOYSA-NSynonyms
926257-72-94(4chloro35dimethyl1Hpyrazol1yl)benzoicacid
4(4CHLORO35DIMETHYLPYRAZOL1YL)BENZOICACID
4(4CHLORO35DIMETHYLPYRAZOLYL)BENZOICACID
926257729
CC1=C(C(=NN1C2=CC=C(C=C2)C(=O)O)C)Cl
InChI=1SC12H11ClN2O2c1711(13)8(2)15(147)10539(4610)12(16)17h36H12H3(H1617)
MFCD06371355
ZINC000003340132
ZINC3340132
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