Vitas-M small molecule compound
(3Z)-3-(4-tert-butylbenzylidene)-5-(4-chlorophenyl)furan-2(3H)-one
Catalog ID
STK192359
SMILES Clc1ccc(cc1)C1=C/C(=C/c2ccc(cc2)C(C)(C)C)/C(=O)O1
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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 C21H19ClO2 MW 338.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClO2/c1-21(2,3)17-8-4-14(5-9-17)12-16-13-19(24-20(16)23)15-6-10-18(22)11-7-15/h4-13H,1-3H3/b16-12-InChIKey
ZQCAKDUIFZNGQS-VBKFSLOCSA-NSynonyms
(3Z)3((4TERTBUTYLPHENYL)METHYLIDENE)5(4CHLOROPHENYL)FURAN2ONE
(3Z)3(4TERTBUTYLBENZYLIDENE)5(4CHLOROPHENYL)FURAN2(3H)ONE
CC(C)(C)C1=CC=C(C=C1)C=C2C=C(OC2=O)C3=CC=C(C=C3)Cl
Clc1ccc(cc1)C1=CC(=Cc2ccc(cc2)C(C)(C)C)C(=O)O1
InChI=1SC21H19ClO2c121(23)178414(5917)12161319(2420(16)23)1561018(22)11715h413H13H3b1612
MFCD04308115
ZINC000004743229
ZINC04743229
ZINC4743229
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