Vitas-M small molecule compound

4-bromo-3,5-dimethyl-2-(4-nitrobenzyl)-2H-pyrrole

Catalog ID
STK349878
SMILES CC1=C(Br)C(=NC1Cc1ccc(cc1)[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 C13H13BrN2O2 MW 309.16 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13BrN2O2/c1-8-12(15-9(2)13(8)14)7-10-3-5-11(6-4-10)16(17)18/h3-6,12H,7H2,1-2H3
InChIKey
QHZFXKDNBZDPDL-UHFFFAOYSA-N
Synonyms
937602-06-7
4BROMO35DIMETHYL2((4NITROPHENYL)METHYL)2HPYRROLE
4bromo35dimethyl2(4nitrobenzyl)2Hpyrrole
937602067
CC1=C(Br)C(=NC1Cc1ccc(cc1)(N+)(=O)(O))C
CC1=C(C(=NC1CC2=CC=C(C=C2)(N+)(=O)(O))C)Br
InChI=1SC13H13BrN2O2c1812(159(2)13(8)14)7103511(6410)16(17)18h3612H7H212H3
MFCD08558494
ZINC000012357663
ZINC000012357664

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Available files

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