Vitas-M small molecule compound

2-methyl-N-(2-methyl-4-nitrophenyl)butanamide

Catalog ID
STK020319
SMILES CCC(C(=O)Nc1ccc(cc1C)[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/c1-4-8(2)12(15)13-11-6-5-10(14(16)17)7-9(11)3/h5-8H,4H2,1-3H3,(H,13,15)
InChIKey
BRTLNXCOEWAONG-UHFFFAOYSA-N
Synonyms
335204-58-5
2METHYLN(2METHYL4NITROPHENYL)BUTANAMIDE
2METHYLN(2METHYL4NITROPHENYL)BUTYRAMIDE
335204585
CCC(C(=O)Nc1ccc(cc1C)(N+)(=O)(O))C
CCC(C)C(=O)NC1=C(C=C(C=C1)(N+)(=O)(O))C
InChI=1SC12H16N2O3c148(2)12(15)13116510(14(16)17)79(11)3h58H4H213H3(H1315)
MFCD02577173
N(4NITRO2METHYLPHENYL)2METHYLBUTANAMIDE
STK020319
ZINC000004589843
ZINC000004589847

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Available files

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