Vitas-M small molecule compound

methyl 2-bromo-3-nitrobenzoate

Catalog ID
STK366097
SMILES COC(=O)c1cccc(c1Br)[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 C8H6BrNO4 MW 260.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C8H6BrNO4/c1-14-8(11)5-3-2-4-6(7(5)9)10(12)13/h2-4H,1H3
InChIKey
YUWPKYJCYRFBJT-UHFFFAOYSA-N
Synonyms

2BROMO3NITROBENZOICACIDMETHYLESTER
2BROMO3NITROBENZOICACIMETHYLESTER
BENZOICACID2BROMO3NITROMETHYLESTER
COC(=O)C1=C(C(=CC=C1)(N+)(=O)(O))Br
COC(=O)c1cccc(c1Br)(N+)(=O)(O)
InChI=1SC8H6BrNO4c1148(11)53246(7(5)9)10(12)13h24H1H3
methyl2bromo3nitrobenzoate
MFCD00087891
ZINC000001433281
ZINC01433281
ZINC1433281

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Available files

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