Vitas-M small molecule compound
1-(2-methoxy-4-nitrophenyl)-3,5-dimethyl-1H-pyrazole-4-carbaldehyde
Catalog ID
STL199537
SMILES COc1cc(ccc1n1nc(c(c1C)C=O)C)[N+](=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 C13H13N3O4 MW 275.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13N3O4/c1-8-11(7-17)9(2)15(14-8)12-5-4-10(16(18)19)6-13(12)20-3/h4-7H,1-3H3InChIKey
FOBMESLWHVPYAV-UHFFFAOYSA-NSynonyms
1159697-62-71(2methoxy4nitrophenyl)35dimethyl1Hpyrazole4carbaldehyde
1(2methoxy4nitrophenyl)35dimethylpyrazole4carbaldehyde
1159697627
CC1=C(C(=NN1C2=C(C=C(C=C2)(N+)(=O)(O))OC)C)C=O
COc1cc(ccc1n1nc(c(c1C)C=O)C)(N+)(=O)(O)
InChI=1SC13H13N3O4c1811(717)9(2)15(148)125410(16(18)19)613(12)203h47H13H3
MFCD09836285
ZINC000059549670
ZINC59549670
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