Methanesulfonyl chloride → Methanesulfonic acid 1-[3-(4-trifluoromethoxy-phenyl)-prop-2-ynyl]-cyclobutylmethyl ester

반응식

[CH3:21][S:22]([Cl:23])(=[O:24])=[O:25].[F:1][C:2]([O:3][c:4]1[cH:5][cH:6][c:7]([C:10]#[C:11][CH2:12][C:13]2([CH2:17][OH:18])[CH2:14][CH2:15][CH2:16]2)[cH:8][cH:9]1)([F:19])[F:20]>>[F:1][C:2]([O:3][c:4]1[cH:5][cH:6][c:7]([C:10]#[C:11][CH2:12][C:13]2([CH2:17][O:18][S:22]([CH3:21])(=[O:24])=[O:25])[CH2:14][CH2:15][CH2:16]2)[cH:8][cH:9]1)([F:19])[F:20]

참가 물질

반응물 2

HCID 31297Methanesulfonyl chloride

HCID 69458280{1-[3-(4-Trifluoromethoxy-phenyl)-prop-2-ynyl]-cyclobutyl}-methanol

생성물 1

HCID 86602545Methanesulfonic acid 1-[3-(4-trifluoromethoxy-phenyl)-prop-2-ynyl]-cyclobutylmethyl ester

출처 및 근거

ORD 기록: ord-afe7c0b97f1f4bf594b2c23fbd1a4f56
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

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