Water → [(4-Chlorobutyl)thio]acetic acid methyl ester
반응식
[Br:12][CH2:13][CH2:14][CH2:15][CH2:16][Cl:17].[C:1]([CH2:2][SH:3])(=[O:4])[O:5][CH3:6].[CH2:7]([Li:8])[CH2:9][CH2:10][CH3:11].[CH3:24][CH2:25][O:26][C:27](=[O:28])[CH3:29].[O:19]1[CH2:20][CH2:21][CH2:22][CH2:23]1.[OH2:18]>>[C:1]([CH2:2][S:3][CH2:13][CH2:14][CH2:15][CH2:16][Cl:17])(=[O:4])[O:5][CH3:6]참가 물질
7
출처 및 근거
- ORD 기록
- ord-49156d96f7ea49edb3e17539da0eb376
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
반응 노트
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