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【结 构 式】

【分子编号】48098

【品名】ethyl (diethoxyphosphoryl)methanesulfonate

【CA登记号】

【 分 子 式 】C7H17O6PS

【 分 子 量 】260.248142

【元素组成】C 32.31% H 6.58% O 36.89% P 11.9% S 12.32%

与该中间体有关的原料药合成路线共 1 条

合成路线1

该中间体在本合成路线中的序号:(II)

The lithium anion of ethyl methanesulfonate (I) was condensed with ethyl chlorophosphonate to produce the phosphonate (II), which was subsequently subjected to a Wittig reaction with 5-chlorotiophene-2-carboxaldehyde (III), yielding olefin (IV). After cleavage of the ethyl sulfonate of (IV) by means of tetrabutylammonium iodide, treatment with sulfuryl chloride afforded the intermediate sulfonyl chloride (V).

2 Myers, M.R.; Becker, M.R.; Ewing, W.R.; Spada, A.P. (Aventis Pharmaceuticals, Inc.); Substd. oxoazaheterocyclyl factor Xa inhibitors. WO 0032590; WO 0107436 .
1 Hanney, B.A.; He, W.; Poli, G.B.; Spada, A.P.; Myers, M.R.; Burns, C.J.; Pauls, H.W.; Jiang, J.Z.; Condon, S.M.; Ewing, W.R.; Becker, M.R.; Li, A.; Choi-Sledeski, Y.M.; Lau, W.F.; Davis, R.S. (Aventis Pharmaceuticals, Inc.); Substd. oxoazaheterocyclyl factor Xa inhibitors. EP 1051176; WO 9937304 .
中间体序号 中间体编号 品名 CAS号 分子式 供应商 用于合成
(I) 48097 ethyl methanesulfonate;ethylmesylate;ethyl methanesulphonate;O-ethylmethylsulfonate 62-50-0 C3H8O3S 详情 详情
(II) 48098 ethyl (diethoxyphosphoryl)methanesulfonate C7H17O6PS 详情 详情
(III) 48099 5-chloro-2-thiophenecarbaldehyde 7283-96-7 C5H3ClOS 详情 详情
(IV) 48100 ethyl (E)-2-(5-chloro-2-thienyl)-1-ethenesulfonate C8H9ClO3S2 详情 详情
(V) 48101 (E)-2-(5-chloro-2-thienyl)-1-ethenesulfonyl chloride C6H4Cl2O2S2 详情 详情
Extended Information