Vitas-M small molecule compound
4-iodophenyl 2,4-di-tert-butylcyclohexanecarboxylate
Catalog ID
STL508215
SMILES O=C(C1CCC(CC1C(C)(C)C)C(C)(C)C)Oc1ccc(cc1)I
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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 C21H31IO2 MW 442.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H31IO2/c1-20(2,3)14-7-12-17(18(13-14)21(4,5)6)19(23)24-16-10-8-15(22)9-11-16/h8-11,14,17-18H,7,12-13H2,1-6H3InChIKey
SXCNJZUGLYFXKJ-UHFFFAOYSA-NSynonyms
(4iodophenyl)24di~(tert)butylcyclohexane1carboxylate
132452432
4iodophenyl24ditertbutylcyclohexanecarboxylate
InChI=1SC21H31IO2c120(23)1471217(18(1314)21(45)6)19(23)241610815(22)91116h811141718H71213H216H3
MFCD31615162
ZINC001505840708
ZINC001505840711
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