Vitas-M small molecule compound
(2E,6E)-2,6-bis{[5-(3-chlorophenyl)furan-2-yl]methylidene}cyclohexanone
Catalog ID
STL175529
SMILES Clc1cccc(c1)c1ccc(o1)/C=C/1\CCC/C(=C\c2ccc(o2)c2cccc(c2)Cl)/C1=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 C28H20Cl2O3 MW 475.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H20Cl2O3/c29-22-8-2-4-18(14-22)26-12-10-24(32-26)16-20-6-1-7-21(28(20)31)17-25-11-13-27(33-25)19-5-3-9-23(30)15-19/h2-5,8-17H,1,6-7H2/b20-16+,21-17+InChIKey
LERAUHWLHDMHNX-NWILIBCHSA-NSynonyms
87296-55-7(2E6E)26BIS((5(3CHLOROPHENYL)FURAN2YL)METHYLIDENE)CYCLOHEXAN1ONE
(2E6E)26bis((5(3chlorophenyl)furan2yl)methylidene)cyclohexanone
87296557
C1CC(=CC2=CC=C(O2)C3=CC(=CC=C3)Cl)C(=O)C(=CC4=CC=C(O4)C5=CC(=CC=C5)Cl)C1
Clc1cccc(c1)c1ccc(o1)C=C1CCCC(=Cc2ccc(o2)c2cccc(c2)Cl)C1=O
InChI=1SC28H20Cl2O3c292282418(1422)26121024(3226)162061721(28(20)31)1725111327(3325)1953923(30)1519h25817H167H2b2016+2117+
MFCD03783565
ZINC000008383292
ZINC08383292
ZINC39764241
ZINC8383292
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