Vitas-M small molecule compound
butyl (9Z)-2,5,7-trinitro-9-(5-phenyl-3H-1,2-dithiol-3-ylidene)-9H-fluorene-4-carboxylate
Catalog ID
STK726876
SMILES CCCCOC(=O)c1cc(cc2c1c1c(/C/2=C/2\SSC(=C2)c2ccccc2)cc(cc1[N+](=O)[O-])[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 C27H19N3O8S2 MW 577.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19N3O8S2/c1-2-3-9-38-27(31)20-12-16(28(32)33)10-18-24(23-14-22(39-40-23)15-7-5-4-6-8-15)19-11-17(29(34)35)13-21(30(36)37)26(19)25(18)20/h4-8,10-14H,2-3,9H2,1H3/b24-23-InChIKey
OPNIUZCQCNJSFI-VHXPQNKSSA-NSynonyms
(Z)butyl257trinitro9(5phenyl3H12dithiol3ylidene)9Hfluorene4carboxylate
butyl(9Z)257trinitro9(5phenyl3H12dithiol3ylidene)9Hfluorene4carboxylate
BUTYL(9Z)257TRINITRO9(5PHENYLDITHIOL3YLIDENE)FLUORENE4CARBOXYLATE
CCCCOC(=O)C1=C2C(=CC(=C1)(N+)(=O)(O))C(=C3C=C(SS3)C4=CC=CC=C4)C5=CC(=CC(=C52)(N+)(=O)(O))(N+)(=O)(O)
CCCCOC(=O)c1cc(cc2c1c1c(C2=C2SSC(=C2)c2ccccc2)cc(cc1(N+)(=O)(O))(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC27H19N3O8S2c12393827(31)201216(28(32)33)101824(231422(394023)157546815)191117(29(34)35)1321(30(36)37)26(19)25(18)20h481014H239H21H3b2423
MFCD01795138
ZINC000102643441
ZINC102643441
Check stock
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