4-ethoxybenzenesulfonic Acid → 2-Oxooctyl-p-ethoxybenzene sulfonate

HRID 88349노트

반응식

HRID 88349 반응식
[CH2:12]([CH3:13])[O:14][c:15]1[cH:16][cH:17][c:18]([S:21](=[O:22])(=[O:23])[OH:24])[cH:19][cH:20]1.[N+:1](=[N-:2])=[CH:3][C:4]([CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH3:10])=[O:11]>>[CH2:3]([C:4]([CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH3:10])=[O:11])[O:24][S:21]([c:18]1[cH:17][cH:16][c:15]([O:14][CH2:12][CH3:13])[cH:20][cH:19]1)(=[O:22])=[O:23]

참가 물질

3

출처 및 근거

ORD 기록
ord-e7297c279e4744f7b936c774ca9a7da4
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

반응 노트

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