Vitas-M small molecule compound
4-[(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]benzoic acid
Catalog ID
STK709473
SMILES [O-][N+](=O)c1nn(c(c1Cl)C)Cc1ccc(cc1)C(=O)O
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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 C12H10ClN3O4 MW 295.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H10ClN3O4/c1-7-10(13)11(16(19)20)14-15(7)6-8-2-4-9(5-3-8)12(17)18/h2-5H,6H2,1H3,(H,17,18)InChIKey
RPDSHNBIFOPINO-UHFFFAOYSA-NSynonyms
491831-83-5(O)(N+)(=O)c1nn(c(c1Cl)C)Cc1ccc(cc1)C(=O)O
4((4CHLORO3NITRO5METHYL1HPYRAZOL1YL)METHYL)BENZOICACID
4((4chloro5methyl3nitro1Hpyrazol1yl)methyl)benzoicacid
4((4CHLORO5METHYL3NITROPYRAZOL1YL)METHYL)BENZOICACID
4((4CHLORO5METHYL3NITROPYRAZOLYL)METHYL)BENZOICACID
4(4CHLORO5METHYL3NITROPYRAZOL1YLMETHYL)BENZOICACID
491831835
CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)O)(N+)(=O)(O))Cl
InChI=1SC12H10ClN3O4c1710(13)11(16(19)20)1415(7)68249(538)12(17)18h25H6H21H3(H1718)
MFCD01114905
ZINC000000368983
ZINC368983
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