Vitas-M small molecule compound

(2E)-3-{5-bromo-2-[(4-methylbenzyl)oxy]phenyl}prop-2-enoic acid

Catalog ID
STL553902
SMILES OC(=O)/C=C/c1cc(Br)ccc1OCc1ccc(cc1)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 C17H15BrO3 MW 347.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15BrO3/c1-12-2-4-13(5-3-12)11-21-16-8-7-15(18)10-14(16)6-9-17(19)20/h2-10H,11H2,1H3,(H,19,20)/b9-6+
InChIKey
XVVLCDDXBXYLES-RMKNXTFCSA-N
Synonyms
938301-03-2
(~(E))3(5bromo2((4methylphenyl)methoxy)phenyl)prop2enoicacid
(2E)3(5bromo2((4methylbenzyl)oxy)phenyl)prop2enoicacid
(E)3(5BROMO2((4METHYLPHENYL)METHOXY)PHENYL)PROP2ENOICACID
3(5BROMO2(4METHYLBENZYLOXY)PHENYL)ACRYLICACID
5869893
938301032
InChI=1SC17H15BrO3c1122413(5312)1121168715(18)1014(16)6917(19)20h210H11H21H3(H1920)b96+
MFCD09718262
ZINC000011800083
ZINC11800083

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Available files

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