Vitas-M small molecule compound
(2E)-3-[2-(benzyloxy)-5-bromo-3-iodophenyl]prop-2-enoic acid
Catalog ID
STK398180
SMILES OC(=O)/C=C/c1cc(Br)cc(c1OCc1ccccc1)I
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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 C16H12BrIO3 MW 459.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12BrIO3/c17-13-8-12(6-7-15(19)20)16(14(18)9-13)21-10-11-4-2-1-3-5-11/h1-9H,10H2,(H,19,20)/b7-6+InChIKey
QCOIEHYPKHVYMV-VOTSOKGWSA-NSynonyms
1076196-82-1(2E)3(2(benzyloxy)5bromo3iodophenyl)prop2enoicacid
(E)3(5bromo3iodo2phenylmethoxyphenyl)prop2enoicacid
1076196821
C1=CC=C(C=C1)COC2=C(C=C(C=C2C=CC(=O)O)Br)I
InChI=1SC16H12BrIO3c1713812(6715(19)20)16(14(18)913)2110114213511h19H10H2(H1920)b76+
MFCD02257518
OC(=O)C=Cc1cc(Br)cc(c1OCc1ccccc1)I
ZINC000022077349
ZINC22077349
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