Vitas-M small molecule compound
3-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]benzoic acid
Catalog ID
STK082645
SMILES OC(=O)c1cccc(c1)Cn1nc(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 C13H13ClN2O2 MW 264.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13ClN2O2/c1-8-12(14)9(2)16(15-8)7-10-4-3-5-11(6-10)13(17)18/h3-6H,7H2,1-2H3,(H,17,18)InChIKey
GJHQJRIFWUSACQ-UHFFFAOYSA-NSynonyms
386705-82-43((4CHLORO35DIMETHYL1HPYRAZOL1YL)METHYL)BENZOICACID
3((4CHLORO35DIMETHYLPYRAZOL1YL)METHYL)BENZOICACID
3((4CHLORO35DIMETHYLPYRAZOLYL)METHYL)BENZOICACID
3(4CHLORO35DIMETHYLPYRAZOL1YLMETHYL)BENZOICACID
386705824
CC1=C(C(=NN1CC2=CC=CC(=C2)C(=O)O)C)Cl
InChI=1SC13H13ClN2O2c1812(14)9(2)16(158)71043511(610)13(17)18h36H7H212H3(H1718)
MFCD01114898
OC(=O)c1cccc(c1)Cn1nc(c(c1C)Cl)C
STK082645
ZINC000000368967
ZINC368967
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