6-Chloropiperonyl chloride → Tert-butyl 2-[[4-[(6-chloro-1,3-benzodioxol-5-yl)methoxy]phenoxy]methyl]pyrrolidine-1-carboxylate

반응식

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH:9]([CH2:13][O:14][c:15]2[cH:16][cH:17][c:18]([OH:21])[cH:19][cH:20]2)[CH2:10][CH2:11][CH2:12]1.[Cl:22][c:23]1[cH:24][c:25]2[c:26]([cH:30][c:31]1[CH2:32][Cl:33])[O:27][CH2:28][O:29]2>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH:9]([CH2:13][O:14][c:15]2[cH:16][cH:17][c:18]([O:21][CH2:32][c:31]3[c:23]([Cl:22])[cH:24][c:25]4[c:26]([cH:30]3)[O:27][CH2:28][O:29]4)[cH:19][cH:20]2)[CH2:10][CH2:11][CH2:12]1

참가 물질

반응물 2

HCID 901136-Chloropiperonyl chloride

HCID 59752861(4-Hydroxy-phenoxymethyl)-pyrrolidine-1-carboxylic acid tert-butyl ester

생성물 1

HCID 68998675Tert-butyl 2-[[4-[(6-chloro-1,3-benzodioxol-5-yl)methoxy]phenoxy]methyl]pyrrolidine-1-carboxylate

출처 및 근거

ORD 기록: ord-bbc2f7feec46400fba0c2ff48f7c5110
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

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