Vitas-M small molecule compound
5-methylbenzene-1,3-diyl bis(3,5-dinitrobenzoate)
Catalog ID
STK388885
SMILES Cc1cc(cc(c1)OC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-])OC(=O)c1cc(cc(c1)[N+](=O)[O-])[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 C21H12N4O12 MW 512.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H12N4O12/c1-11-2-18(36-20(26)12-4-14(22(28)29)8-15(5-12)23(30)31)10-19(3-11)37-21(27)13-6-16(24(32)33)9-17(7-13)25(34)35/h2-10H,1H3InChIKey
KFCKYDABKWKZQY-UHFFFAOYSA-NSynonyms
412966-26-8(3(35DINITROBENZOYL)OXY5METHYLPHENYL)35DINITROBENZOATE
412966268
5methylbenzene13diylbis(35dinitrobenzoate)
CC1=CC(=CC(=C1)OC(=O)C2=CC(=CC(=C2)(N+)(=O)(O))(N+)(=O)(O))OC(=O)C3=CC(=CC(=C3)(N+)(=O)(O))(N+)(=O)(O)
Cc1cc(cc(c1)OC(=O)c1cc(cc(c1)(N+)(=O)(O))(N+)(=O)(O))OC(=O)c1cc(cc(c1)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC21H12N4O12c111218(3620(26)12414(22(28)29)815(512)23(30)31)1019(311)3721(27)13616(24(32)33)917(713)25(34)35h210H1H3
MFCD00311602
ZINC000100346400
ZINC100346400
Check stock
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Check stock on Vitas-MAvailable files
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