Vitas-M small molecule compound
2-bromo-4-methyl-1,3,5-trinitrobenzene
Catalog ID
STL371281
SMILES [O-][N+](=O)c1cc([N+](=O)[O-])c(c(c1C)[N+](=O)[O-])Br
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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 C7H4BrN3O6 MW 306.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C7H4BrN3O6/c1-3-4(9(12)13)2-5(10(14)15)6(8)7(3)11(16)17/h2H,1H3InChIKey
IKHFDQSVNNIGEN-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1cc((N+)(=O)(O))c(c(c1C)(N+)(=O)(O))Br
2bromo4methyl135trinitrobenzene
3BROMO246TRINITROTOLUENE
3BROMO26TRINITROTOLUENE
CC1=C(C(=C(C=C1(N+)(=O)(O))(N+)(=O)(O))Br)(N+)(=O)(O)
InChI=1SC7H4BrN3O6c134(9(12)13)25(10(14)15)6(8)7(3)11(16)17h2H1H3
MFCD00434718
ZINC000066114644
ZINC66114644
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