Vitas-M small molecule compound
3-bromo-4-{[(2-chlorophenyl)carbonyl]oxy}-5-ethoxybenzoic acid
Catalog ID
STL426707
SMILES CCOc1cc(cc(c1OC(=O)c1ccccc1Cl)Br)C(=O)O
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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 C16H12BrClO5 MW 399.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12BrClO5/c1-2-22-13-8-9(15(19)20)7-11(17)14(13)23-16(21)10-5-3-4-6-12(10)18/h3-8H,2H2,1H3,(H,19,20)InChIKey
OKMMOGOGOLFHQM-UHFFFAOYSA-NSynonyms
3bromo4(((2chlorophenyl)carbonyl)oxy)5ethoxybenzoicacid
3bromo4(2chlorobenzoyl)oxy5ethoxybenzoicacid
CCOC1=C(C(=CC(=C1)C(=O)O)Br)OC(=O)C2=CC=CC=C2Cl
InChI=1SC16H12BrClO5c12221389(15(19)20)711(17)14(13)2316(21)10534612(10)18h38H2H21H3(H1920)
MFCD29036251
ZINC000227156782
ZINC227156782
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