Vitas-M small molecule compound

(2E,6E)-2,6-bis{[5-(3,4-dichlorophenyl)furan-2-yl]methylidene}-4-methylcyclohexanone

Catalog ID
STL069909
SMILES CC1C/C(=C\c2ccc(o2)c2ccc(c(c2)Cl)Cl)/C(=O)/C(=C/c2ccc(o2)c2ccc(c(c2)Cl)Cl)/C1

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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 C29H20Cl4O3 MW 558.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H20Cl4O3/c1-16-10-19(12-21-4-8-27(35-21)17-2-6-23(30)25(32)14-17)29(34)20(11-16)13-22-5-9-28(36-22)18-3-7-24(31)26(33)15-18/h2-9,12-16H,10-11H2,1H3/b19-12+,20-13+
InChIKey
LLRIOIKHJAIFDL-KVOOEGMKSA-N
Synonyms

(2E6E)26bis((5(34dichlorophenyl)furan2yl)methylene)4methylcyclohexanone
(2E6E)26BIS((5(34DICHLOROPHENYL)FURAN2YL)METHYLIDENE)4METHYLCYCLOHEXAN1ONE
(2E6E)26bis((5(34dichlorophenyl)furan2yl)methylidene)4methylcyclohexanone
26BIS((5(34DICHLOROPHENYL)(2FURYL))METHYLENE)4METHYLCYCLOHEXAN1ONE
CC1CC(=CC2=CC=C(O2)C3=CC(=C(C=C3)Cl)Cl)C(=O)C(=CC4=CC=C(O4)C5=CC(=C(C=C5)Cl)Cl)C1
CC1CC(=Cc2ccc(o2)c2ccc(c(c2)Cl)Cl)C(=O)C(=Cc2ccc(o2)c2ccc(c(c2)Cl)Cl)C1
InChI=1SC29H20Cl4O3c1161019(12214827(3521)172623(30)25(32)1417)29(34)20(1116)13225928(3622)183724(31)26(33)1518h291216H1011H21H3b1912+2013+
MFCD03299711
ZINC000097968936
ZINC97968936

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Available files

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