Vitas-M small molecule compound
2-[(2E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]-4-methylphenyl 2-bromobenzoate
Catalog ID
STK888251
SMILES COc1cc(/C=C/C(=O)c2cc(C)ccc2OC(=O)c2ccccc2Br)ccc1OC
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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 C25H21BrO5 MW 481.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21BrO5/c1-16-8-12-22(31-25(28)18-6-4-5-7-20(18)26)19(14-16)21(27)11-9-17-10-13-23(29-2)24(15-17)30-3/h4-15H,1-3H3/b11-9+InChIKey
IFCKSQVNUJLPAE-PKNBQFBNSA-NSynonyms
433324-29-9(2((E)3(34DIMETHOXYPHENYL)PROP2ENOYL)4METHYLPHENYL)2BROMOBENZOATE
(E)2(3(34dimethoxyphenyl)acryloyl)4methylphenyl2bromobenzoate
2((2E)3(34dimethoxyphenyl)prop2enoyl)4methylphenyl2bromobenzoate
433324299
CC1=CC(=C(C=C1)OC(=O)C2=CC=CC=C2Br)C(=O)C=CC3=CC(=C(C=C3)OC)OC
COc1cc(C=CC(=O)c2cc(C)ccc2OC(=O)c2ccccc2Br)ccc1OC
InChI=1SC25H21BrO5c11681222(3125(28)18645720(18)26)19(1416)21(27)11917101323(292)24(1517)303h415H13H3b119+
MFCD03288770
ZINC000009019217
ZINC09019217
ZINC9019217
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