Isoquinolin-5-ol → Bromide ion

HRID 294693노트

반응식

HRID 294693 반응식
[F:12][c:13]1[cH:14][cH:15][c:16]([CH:19]([CH2:20][CH2:21][CH2:22][Br:23])[c:24]2[cH:25][cH:26][c:27]([F:30])[cH:28][cH:29]2)[cH:17][cH:18]1.[OH:1][c:2]1[c:3]2[cH:4][cH:5][n:6][cH:7][c:8]2[cH:9][cH:10][cH:11]1>>[Br-:23].[OH:1][c:2]1[c:3]2[cH:4][cH:5][n+:6]([CH2:22][CH2:21][CH2:20][CH:19]([c:16]3[cH:15][cH:14][c:13]([F:12])[cH:18][cH:17]3)[c:24]3[cH:25][cH:26][c:27]([F:30])[cH:28][cH:29]3)[cH:7][c:8]2[cH:9][cH:10][cH:11]1

참가 물질

4

반응물 2

HCID 30386Isoquinolin-5-olHCID 937631,1'-(4-Bromobutylidene)bis[4-fluorobenzene]

생성물 2

HCID 259Bromide ionHCID 158708922-[4,4-Bis(4-fluorophenyl)butyl]isoquinolin-2-ium-5-ol

출처 및 근거

ORD 기록
ord-11e0ab0108c943f791d349835f523dea
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

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