Vitas-M small molecule compound

(2-methyl-3,5-dinitrophenyl)(piperidin-1-yl)methanone

Catalog ID
STK164596
SMILES [O-][N+](=O)c1cc(C(=O)N2CCCCC2)c(c(c1)[N+](=O)[O-])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 C13H15N3O5 MW 293.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15N3O5/c1-9-11(13(17)14-5-3-2-4-6-14)7-10(15(18)19)8-12(9)16(20)21/h7-8H,2-6H2,1H3
InChIKey
NYUIMWZLXPIUTJ-UHFFFAOYSA-N
Synonyms
52090-27-4
(2METHYL35DINITROPHENYL)(PIPERIDIN1YL)METHANONE
(2METHYL35DINITROPHENYL)PIPERIDIN1YLMETHANONE
(O)(N+)(=O)c1cc(C(=O)N2CCCCC2)c(c(c1)(N+)(=O)(O))C
1(2METHYL35DINITROBENZOYL)PIPERIDINE
2METHYL35DINITROPHENYLPIPERIDYLKETONE
52090274
CC1=C(C=C(C=C1C(=O)N2CCCCC2)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC13H15N3O5c1911(13(17)145324614)710(15(18)19)812(9)16(20)21h78H26H21H3
MFCD00416597
ZINC000003154501
ZINC03154501
ZINC3154501

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.