Vitas-M small molecule compound

(2-methyl-3-nitrophenyl)(morpholin-4-yl)methanone

Catalog ID
STK416431
SMILES O=C(c1cccc(c1C)[N+](=O)[O-])N1CCOCC1

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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 C12H14N2O4 MW 250.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14N2O4/c1-9-10(3-2-4-11(9)14(16)17)12(15)13-5-7-18-8-6-13/h2-4H,5-8H2,1H3
InChIKey
NYNRRBUOLNYJSV-UHFFFAOYSA-N
Synonyms

(2methyl3nitrophenyl)(morpholin4yl)methanone
(2METHYL3NITROPHENYL)MORPHOLIN4YLMETHANONE
2METHYL3NITROPHENYLMORPHOLIN4YLKETONE
4(2METHYL3NITROBENZOYL)MORPHOLINE
CC1=C(C=CC=C1(N+)(=O)(O))C(=O)N2CCOCC2
InChI=1SC12H14N2O4c1910(32411(9)14(16)17)12(15)1357188613h24H58H21H3
MFCD01213353
O=C(c1cccc(c1C)(N+)(=O)(O))N1CCOCC1
ZINC000000493483
ZINC00493483
ZINC493483

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Available files

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