Vitas-M small molecule compound
(2Z)-2-(4-tert-butylbenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl 1,3-benzodioxole-5-carboxylate
Catalog ID
STK992266
SMILES O=C1/C(=C/c2ccc(cc2)C(C)(C)C)/Oc2c1ccc(c2)OC(=O)c1ccc2c(c1)OCO2
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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 C27H22O6 MW 442.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22O6/c1-27(2,3)18-7-4-16(5-8-18)12-24-25(28)20-10-9-19(14-22(20)33-24)32-26(29)17-6-11-21-23(13-17)31-15-30-21/h4-14H,15H2,1-3H3/b24-12-InChIKey
GYLYNPFQYSJXBG-MSXFZWOLSA-NSynonyms
622801-12-1((2Z)2((4TERTBUTYLPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)13BENZODIOXOLE5CARBOXYLATE
(2Z)2(4tertbutylbenzylidene)3oxo23dihydro1benzofuran6yl13benzodioxole5carboxylate
(Z)2(4(tertbutyl)benzylidene)3oxo23dihydrobenzofuran6ylbenzo(d)(13)dioxole5carboxylate
2((4(TERTBUTYL)PHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YL2HBENZO(34D)13DIOXOLENE5CARBOXYLATE
622801121
CC(C)(C)C1=CC=C(C=C1)C=C2C(=O)C3=C(O2)C=C(C=C3)OC(=O)C4=CC5=C(C=C4)OCO5
InChI=1SC27H22O6c127(23)187416(5818)122425(28)2010919(1422(20)3324)3226(29)176112123(1317)31153021h414H15H213H3b2412
MFCD04167318
O=C1C(=Cc2ccc(cc2)C(C)(C)C)Oc2c1ccc(c2)OC(=O)c1ccc2c(c1)OCO2
ZINC000002414254
ZINC02414254
ZINC2414254
Check stock
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Check stock on Vitas-MAvailable files
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