Vitas-M small molecule compound
(2Z)-2-(3-methylbenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl 2,2-dimethylpropanoate
Catalog ID
STK626215
SMILES Cc1cccc(c1)/C=C/1\Oc2c(C1=O)ccc(c2)OC(=O)C(C)(C)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 C21H20O4 MW 336.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20O4/c1-13-6-5-7-14(10-13)11-18-19(22)16-9-8-15(12-17(16)25-18)24-20(23)21(2,3)4/h5-12H,1-4H3/b18-11-InChIKey
QKUKZDOIJAUWHP-WQRHYEAKSA-NSynonyms
622360-18-3((2Z)2((3methylphenyl)methylidene)3oxo1benzofuran6yl)22dimethylpropanoate
(2Z)2(3methylbenzylidene)3oxo23dihydro1benzofuran6yl22dimethylpropanoate
(Z)2(3methylbenzylidene)3oxo23dihydrobenzofuran6ylpivalate
2((3METHYLPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YL22DIMETHYLPROPANOATE
622360183
CC1=CC=CC(=C1)C=C2C(=O)C3=C(O2)C=C(C=C3)OC(=O)C(C)(C)C
Cc1cccc(c1)C=C1Oc2c(C1=O)ccc(c2)OC(=O)C(C)(C)C
InChI=1SC21H20O4c11365714(1013)111819(22)169815(1217(16)2518)2420(23)21(23)4h512H14H3b1811
MFCD06291944
ZINC000009419476
ZINC09419476
ZINC9419476
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