Vitas-M small molecule compound
2-methyl-6,7-dinitro-1H-benzo[de]isoquinoline-1,3(2H)-dione
Catalog ID
STL294672
SMILES [O-][N+](=O)c1ccc2c3c1c(ccc3c(=O)n(c2=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 C13H7N3O6 MW 301.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H7N3O6/c1-14-12(17)6-2-4-8(15(19)20)11-9(16(21)22)5-3-7(10(6)11)13(14)18/h2-5H,1H3InChIKey
VAVLFLWKGDHZEN-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1ccc2c3c1c(ccc3c(=O)n(c2=O)C)(N+)(=O)(O)
2methyl67dinitro1Hbenzo(de)isoquinoline13(2H)dione
2methyl67dinitrobenzo(de)isoquinoline13dione
CN1C(=O)C2=C3C(=CC=C(C3=C(C=C2)(N+)(=O)(O))(N+)(=O)(O))C1=O
InChI=1SC13H7N3O6c11412(17)6248(15(19)20)119(16(21)22)537(10(6)11)13(14)18h25H1H3
MFCD00401467
ZINC000095470768
ZINC95470768
Check stock
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Check stock on Vitas-MAvailable files
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