Vitas-M small molecule compound
2-tert-butyl-5-(4-nitrophenyl)-1,3,4-oxadiazole
Catalog ID
STL120289
SMILES [O-][N+](=O)c1ccc(cc1)c1nnc(o1)C(C)(C)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 C12H13N3O3 MW 247.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13N3O3/c1-12(2,3)11-14-13-10(18-11)8-4-6-9(7-5-8)15(16)17/h4-7H,1-3H3InChIKey
VJMXBOYVKHDVPR-UHFFFAOYSA-NSynonyms
75655-57-1(O)(N+)(=O)c1ccc(cc1)c1nnc(o1)C(C)(C)C
2(4NITROPHENYL)5TERTBUTYL134OXADIAZOLE
2tertbutyl5(4nitrophenyl)134oxadiazole
75655571
CC(C)(C)C1=NN=C(O1)C2=CC=C(C=C2)(N+)(=O)(O)
InChI=1SC12H13N3O3c112(23)11141310(1811)8469(758)15(16)17h47H13H3
MFCD01186248
ZINC000005380151
ZINC05380151
ZINC5380151
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