Vitas-M small molecule compound
2-bromo-4-tert-butylphenyl (4-nitrophenoxy)acetate
Catalog ID
STK059347
SMILES O=C(Oc1ccc(cc1Br)C(C)(C)C)COc1ccc(cc1)[N+](=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 C18H18BrNO5 MW 408.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18BrNO5/c1-18(2,3)12-4-9-16(15(19)10-12)25-17(21)11-24-14-7-5-13(6-8-14)20(22)23/h4-10H,11H2,1-3H3InChIKey
WZYALHJJSUYJFJ-UHFFFAOYSA-NSynonyms
(2BROMO4TERTBUTYLPHENYL)2(4NITROPHENOXY)ACETATE
2BROMO4TERTBUTYLPHENYL(4NITROPHENOXY)ACETATE
4(TERTBUTYL)2BROMOPHENYL2(4NITROPHENOXY)ACETATE
CC(C)(C)C1=CC(=C(C=C1)OC(=O)COC2=CC=C(C=C2)(N+)(=O)(O))Br
InChI=1SC18H18BrNO5c118(23)124916(15(19)1012)2517(21)1124147513(6814)20(22)23h410H11H213H3
MFCD03195292
O=C(Oc1ccc(cc1Br)C(C)(C)C)COc1ccc(cc1)(N+)(=O)(O)
STK059347
ZINC000005839469
ZINC05839469
ZINC5839469
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