Vitas-M small molecule compound

5-chloro-N-(2,2-dimethylpropyl)-2-nitroaniline

Catalog ID
STK171986
SMILES CC(CNc1cc(Cl)ccc1[N+](=O)[O-])(C)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 C11H15ClN2O2 MW 242.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H15ClN2O2/c1-11(2,3)7-13-9-6-8(12)4-5-10(9)14(15)16/h4-6,13H,7H2,1-3H3
InChIKey
URSPAQQBUJWFSA-UHFFFAOYSA-N
Synonyms
725705-48-6
5CHLORON(22DIMETHYLPROPYL)2NITROANILINE
725705486
CC(C)(C)CNC1=C(C=CC(=C1)Cl)(N+)(=O)(O)
CC(CNc1cc(Cl)ccc1(N+)(=O)(O))(C)C
InChI=1SC11H15ClN2O2c111(23)713968(12)4510(9)14(15)16h4613H7H213H3
MFCD05794951
ZINC000004703653
ZINC04703653
ZINC4703653

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Available files

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