Vitas-M small molecule compound

methyl {2-[(2E)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-enoyl]-5-methoxyphenoxy}acetate

Catalog ID
STL513097
SMILES COC(=O)COc1cc(OC)ccc1C(=O)/C=C/c1ccc2c(c1)OCCO2

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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 C21H20O7 MW 384.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20O7/c1-24-15-5-6-16(19(12-15)28-13-21(23)25-2)17(22)7-3-14-4-8-18-20(11-14)27-10-9-26-18/h3-8,11-12H,9-10,13H2,1-2H3/b7-3+
InChIKey
LLBYVGWMMRMNGH-XVNBXDOJSA-N
Synonyms
299951-06-7
(E)methyl2(2(3(23dihydrobenzo(b)(14)dioxin6yl)acryloyl)5methoxyphenoxy)acetate
299951067
5789526
COC(=O)COc1cc(OC)ccc1C(=O)C=Cc1ccc2c(c1)OCCO2
InChI=1SC21H20O7c124155616(19(1215)281321(23)252)17(22)7314481820(1114)271092618h381112H91013H212H3b73+
methyl(2((2E)3(23dihydro14benzodioxin6yl)prop2enoyl)5methoxyphenoxy)acetate
methyl2(2((~(E))3(23dihydro14benzodioxin6yl)prop2enoyl)5methoxyphenoxy)acetate
METHYL2(2((E)3(23DIHYDRO14BENZODIOXIN6YL)PROP2ENOYL)5METHOXYPHENOXY)ACETATE
MFCD00710011
ZINC000004023274
ZINC4023274

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Available files

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