Vitas-M small molecule compound
2-tert-butyl-5-(3-nitrophenyl)-1,3,4-oxadiazole
Catalog ID
STK156474
SMILES [O-][N+](=O)c1cccc(c1)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)8-5-4-6-9(7-8)15(16)17/h4-7H,1-3H3InChIKey
QPPURQMJPACJCL-UHFFFAOYSA-NSynonyms
75655-58-2(O)(N+)(=O)c1cccc(c1)c1nnc(o1)C(C)(C)C
2(TERTBUTYL)5(3NITROPHENYL)134OXADIAZOLE
2TERTBUTYL5(3NITROPHENYL)134OXADIAZOLE
75655582
CC(C)(C)C1=NN=C(O1)C2=CC(=CC=C2)(N+)(=O)(O)
InChI=1SC12H13N3O3c112(23)11141310(1811)85469(78)15(16)17h47H13H3
MFCD00106887
ZINC000000143483
ZINC00143483
ZINC143483
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