Vitas-M small molecule compound
1,5-dimethyl-4-[(4-nitrophenoxy)methyl]-1H-pyrazole
Catalog ID
STL414577
SMILES [O-][N+](=O)c1ccc(cc1)OCc1cnn(c1C)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/c1-9-10(7-13-14(9)2)8-18-12-5-3-11(4-6-12)15(16)17/h3-7H,8H2,1-2H3InChIKey
KAONOTJWYGGXOE-UHFFFAOYSA-NSynonyms
1245772-62-6(O)(N+)(=O)c1ccc(cc1)OCc1cnn(c1C)C
1245772626
15dimethyl4((4nitrophenoxy)methyl)1Hpyrazole
15dimethyl4((4nitrophenoxy)methyl)pyrazole
4((15DIMETHYLPYRAZOL4YL)METHOXY)1NITROBENZENE
CC1=C(C=NN1C)COC2=CC=C(C=C2)(N+)(=O)(O)
InChI=1SC12H13N3O3c1910(71314(9)2)818125311(4612)15(16)17h37H8H212H3
MFCD16345371
ZINC000072334143
ZINC72334143
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