Vitas-M small molecule compound
(2E)-3-(3,5-dibromo-2-butoxyphenyl)prop-2-enoic acid
Catalog ID
STK350981
SMILES CCCCOc1c(Br)cc(cc1/C=C/C(=O)O)Br
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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 C13H14Br2O3 MW 378.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14Br2O3/c1-2-3-6-18-13-9(4-5-12(16)17)7-10(14)8-11(13)15/h4-5,7-8H,2-3,6H2,1H3,(H,16,17)/b5-4+InChIKey
JPSYSSOIGOZIHK-SNAWJCMRSA-NSynonyms
937599-22-9(2E)3(35dibromo2butoxyphenyl)prop2enoicacid
(E)3(35dibromo2butoxyphenyl)prop2enoicacid
937599229
CCCCOC1=C(C=C(C=C1C=CC(=O)O)Br)Br
CCCCOc1c(Br)cc(cc1C=CC(=O)O)Br
InChI=1SC13H14Br2O3c123618139(4512(16)17)710(14)811(13)15h4578H236H21H3(H1617)b54+
MFCD08555037
ZINC000012394680
ZINC12394680
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