Vitas-M small molecule compound
ethyl (2E)-2-cyano-3-(3,5-dibromo-4-hydroxyphenyl)prop-2-enoate
Catalog ID
STL199340
SMILES CCOC(=O)/C(=C/c1cc(Br)c(c(c1)Br)O)/C#N
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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 C12H9Br2NO3 MW 375.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H9Br2NO3/c1-2-18-12(17)8(6-15)3-7-4-9(13)11(16)10(14)5-7/h3-5,16H,2H2,1H3/b8-3+InChIKey
BEKZYRMZNTZRDB-FPYGCLRLSA-NSynonyms
773089-21-7773089217
CCOC(=O)C(=CC1=CC(=C(C(=C1)Br)O)Br)C#N
CCOC(=O)C(=Cc1cc(Br)c(c(c1)Br)O)C#N
ethyl(2E)2cyano3(35dibromo4hydroxyphenyl)prop2enoate
ethyl(E)2cyano3(35dibromo4hydroxyphenyl)prop2enoate
InChI=1SC12H9Br2NO3c121812(17)8(615)3749(13)11(16)10(14)57h3516H2H21H3b83+
MFCD06210268
ZINC72334076
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