Vitas-M small molecule compound

4,8-diethoxy-6-[4-(heptyloxy)phenyl]-1,3-dimethylcyclohepta[c]furanium

Catalog ID
STL059349
SMILES CCCCCCCOc1ccc(cc1)c1cc(OCC)c2c(c(c1)OCC)c([o+]c2C)C

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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 C28H37O4 MW 437.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H37O4/c1-6-9-10-11-12-17-31-24-15-13-22(14-16-24)23-18-25(29-7-2)27-20(4)32-21(5)28(27)26(19-23)30-8-3/h13-16,18-19H,6-12,17H2,1-5H3/q+1
InChIKey
YFSUCHKKTCNSCZ-UHFFFAOYSA-N
Synonyms

(4ETHOXY6(4HEPTOXYPHENYL)13DIMETHYLCYCLOHEPTA(C)FURAN8YLIDENE)ETHYLOXIDANIUM
(O)(Cl)(=O)(=O)=OCCCCCCCOc1ccc(cc1)c1cc(OCC)c2c(c(c1)OCC)c((o+)c2C)C
48DIETHOXY6(4(HEPTYLOXY)PHENYL)13DIMETHYL6CYCLOHEPTA(C)FURANIUM
48diethoxy6(4(heptyloxy)phenyl)13dimethylcyclohepta(c)furan2iumperchlorate
48diethoxy6(4(heptyloxy)phenyl)13dimethylcyclohepta(c)furanium
CCCCCCCOC1=CC=C(C=C1)C2=CC(=(O+)CC)C3=C(OC(=C3C(=C2)OCC)C)C
CCCCCCCOc1ccc(cc1)c1cc(OCC)c2c(c(c1)OCC)c((o+)c2C)C
InChI=1SC28H37O4c169101112173124151322(141624)231825(2972)2720(4)3221(5)28(27)26(1923)3083h13161819H61217H215H3q+1
ZINC97951224

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Available files

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