Vitas-M small molecule compound

(2E)-3-(1-methyl-1H-pyrazol-5-yl)-1-(3-nitrophenyl)prop-2-en-1-one

Catalog ID
STL392752
SMILES O=C(c1cccc(c1)[N+](=O)[O-])/C=C/c1ccnn1C

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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 C13H11N3O3 MW 257.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11N3O3/c1-15-11(7-8-14-15)5-6-13(17)10-3-2-4-12(9-10)16(18)19/h2-9H,1H3/b6-5+
InChIKey
HWSAFHGOEMPFRO-AATRIKPKSA-N
Synonyms
1005618-37-0
(2E)3(1methyl1Hpyrazol5yl)1(3nitrophenyl)prop2en1one
(E)3(2methylpyrazol3yl)1(3nitrophenyl)prop2en1one
CN1C(=CC=N1)C=CC(=O)C2=CC(=CC=C2)(N+)(=O)(O)
O=C(c1cccc(c1)(N+)(=O)(O))C=Cc1ccnn1C
Registry IDs
MFCD04054180
ZINC000006827495
ZINC06827495
ZINC6827495

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Available files

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