Vitas-M small molecule compound

9-[4-(hexyloxy)benzylidene]-2,4,5,7-tetranitro-9H-fluorene

Catalog ID
STK671655
SMILES CCCCCCOc1ccc(cc1)/C=C/1\c2cc(cc(c2c2c1cc(cc2[N+](=O)[O-])[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 C26H22N4O9 MW 534.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22N4O9/c1-2-3-4-5-10-39-19-8-6-16(7-9-19)11-20-21-12-17(27(31)32)14-23(29(35)36)25(21)26-22(20)13-18(28(33)34)15-24(26)30(37)38/h6-9,11-15H,2-5,10H2,1H3
InChIKey
FPYFDRLVJKETIJ-UHFFFAOYSA-N
Synonyms
339255-20-8
339255208
9((4hexoxyphenyl)methylidene)2457tetranitrofluorene
9(4(hexyloxy)benzylidene)2457tetranitro9Hfluorene
CCCCCCOC1=CC=C(C=C1)C=C2C3=CC(=CC(=C3C4=C(C=C(C=C24)(N+)(=O)(O))(N+)(=O)(O))(N+)(=O)(O))(N+)(=O)(O)
CCCCCCOc1ccc(cc1)C=C1c2cc(cc(c2c2c1cc(cc2(N+)(=O)(O))(N+)(=O)(O))(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC26H22N4O9c123451039198616(7919)1120211217(27(31)32)1423(29(35)36)25(21)2622(20)1318(28(33)34)1524(26)30(37)38h691115H2510H21H3
MFCD00180004
ZINC000095682053
ZINC95682053

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Available files

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