Vitas-M small molecule compound

2-bromo-1-tert-butyl-4-nitrobenzene

Catalog ID
STK331794
SMILES Brc1cc(ccc1C(C)(C)C)[N+](=O)[O-]

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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 C10H12BrNO2 MW 258.11 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H12BrNO2/c1-10(2,3)8-5-4-7(12(13)14)6-9(8)11/h4-6H,1-3H3
InChIKey
VIXSTSCFPDRETO-UHFFFAOYSA-N
Synonyms
6310-17-4
1(TERTBUTYL)2BROMO4NITROBENZENE
2BROMO1(TERTBUTYL)4NITROBENZENE
2bromo1tertbutyl4nitrobenzene
2BROMO4NITRO1TERTBUTYLBENZENE
6310174
BENZENE2BROMO1(11DIMETHYLETHYL)4NITRO
Brc1cc(ccc1C(C)(C)C)(N+)(=O)(O)
CC(C)(C)C1=C(C=C(C=C1)(N+)(=O)(O))Br
InChI=1SC10H12BrNO2c110(23)8547(12(13)14)69(8)11h46H13H3
MFCD00126481
ZINC000000133417
ZINC00133417
ZINC133417

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Available files

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