Vitas-M small molecule compound

3-methyl-N-(2-methyl-5-nitrophenyl)butanamide

Catalog ID
STK025391
SMILES CC(CC(=O)Nc1cc(ccc1C)[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 C12H16N2O3 MW 236.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H16N2O3/c1-8(2)6-12(15)13-11-7-10(14(16)17)5-4-9(11)3/h4-5,7-8H,6H2,1-3H3,(H,13,15)
InChIKey
CNOLVFDLMGBELS-UHFFFAOYSA-N
Synonyms
335398-16-8
335398168
3METHYLN(2METHYL5NITROPHENYL)BUTANAMIDE
3METHYLN(2METHYL5NITROPHENYL)BUTYRAMIDE
CC(CC(=O)Nc1cc(ccc1C)(N+)(=O)(O))C
CC1=C(C=C(C=C1)(N+)(=O)(O))NC(=O)CC(C)C
InChI=1SC12H16N2O3c18(2)612(15)1311710(14(16)17)549(11)3h4578H6H213H3(H1315)
MFCD02218375
N(5NITRO2METHYLPHENYL)3METHYLBUTANAMIDE
STK025391
ZINC000000372626
ZINC00372626
ZINC372626

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Available files

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