Vitas-M small molecule compound
ethyl 4-[1-(4-bromophenyl)-1-oxopropan-2-yl]-5,5-dimethyl-2-oxotetrahydrofuran-3-carboxylate
Catalog ID
STK775274
SMILES CCOC(=O)C1C(=O)OC(C1C(C(=O)c1ccc(cc1)Br)C)(C)C
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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 C18H21BrO5 MW 397.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21BrO5/c1-5-23-16(21)13-14(18(3,4)24-17(13)22)10(2)15(20)11-6-8-12(19)9-7-11/h6-10,13-14H,5H2,1-4H3InChIKey
YQLFBVSFZZFICV-UHFFFAOYSA-NSynonyms
847453-69-4847453694
CCOC(=O)C1C(C(OC1=O)(C)C)C(C)C(=O)C2=CC=C(C=C2)Br
ETHYL4(1(4BROMOPHENYL)1OXOPROPAN2YL)55DIMETHYL2OXOOXOLANE3CARBOXYLATE
ETHYL4(1(4BROMOPHENYL)1OXOPROPAN2YL)55DIMETHYL2OXOTETRAHYDROFURAN3CARBOXYLATE
InChI=1SC18H21BrO5c152316(21)1314(18(34)2417(13)22)10(2)15(20)116812(19)9711h6101314H5H214H3
MFCD04155707
ZINC000004686186
ZINC000101584150
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