Vitas-M small molecule compound
1-(3-bromo-4,5-dimethoxyphenyl)-2-nitroethanone
Catalog ID
STL434949
SMILES COc1c(Br)cc(cc1OC)C(=O)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 C10H10BrNO5 MW 304.10 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H10BrNO5/c1-16-9-4-6(8(13)5-12(14)15)3-7(11)10(9)17-2/h3-4H,5H2,1-2H3InChIKey
GGJYJKRSAPAEJP-UHFFFAOYSA-NSynonyms
1(3bromo45dimethoxyphenyl)2nitroethanone
COC1=C(C(=CC(=C1)C(=O)C(N+)(=O)(O))Br)OC
COc1c(Br)cc(cc1OC)C(=O)C(N+)(=O)(O)
InChI=1SC10H10BrNO5c116946(8(13)512(14)15)37(11)10(9)172h34H5H212H3
MFCD28404517
ZINC000100023737
ZINC100023737
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