Vitas-M small molecule compound
(2E)-3-(3-bromo-4-butoxy-5-ethoxyphenyl)prop-2-enoic acid
Catalog ID
STK398219
SMILES CCCCOc1c(Br)cc(cc1OCC)/C=C/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 C15H19BrO4 MW 343.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H19BrO4/c1-3-5-8-20-15-12(16)9-11(6-7-14(17)18)10-13(15)19-4-2/h6-7,9-10H,3-5,8H2,1-2H3,(H,17,18)/b7-6+InChIKey
JQKBDTVAAAPKKC-VOTSOKGWSA-NSynonyms
932889-34-4(2E)3(3bromo4butoxy5ethoxyphenyl)prop2enoicacid
(E)3(3bromo4butoxy5ethoxyphenyl)prop2enoicacid
932889344
CCCCOC1=C(C=C(C=C1Br)C=CC(=O)O)OCC
CCCCOc1c(Br)cc(cc1OCC)C=CC(=O)O
InChI=1SC15H19BrO4c1358201512(16)911(6714(17)18)1013(15)1942h67910H358H212H3(H1718)b76+
MFCD02256595
ZINC000011954800
ZINC11954800
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