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Bromide ion → 1-{3-[2-(1-Benzothiophen-5-yl)ethoxy]propyl}-3-(trityloxy)azetidine

HRID 126142
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HRID 126142 반응식
[Br-:57].[C:15]([OH:16])(=[O:17])[C:18]([OH:19])=[O:20].[CH2:58]([N+:59]([CH2:60][CH2:61][CH2:62][CH3:63])([CH2:64][CH2:65][CH2:66][CH3:67])[CH2:68][CH2:69][CH2:70][CH3:71])[CH2:72][CH2:73][CH3:74].[CH3:50][c:51]1[cH:52][cH:53][cH:54][cH:55][cH:56]1.[Cl:21][CH2:22][CH2:23][CH2:24][N:25]1[CH2:26][CH:27]([O:29][C:30]([c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)([c:37]2[cH:38][cH:39][cH:40][cH:41][cH:42]2)[c:43]2[cH:44][cH:45][cH:46][cH:47][cH:48]2)[CH2:28]1.[Na+:2].[OH-:1].[OH2:49].[s:3]1[cH:4][cH:5][c:6]2[c:7]1[cH:8][cH:9][c:10]([CH2:12][CH2:13][OH:14])[cH:11]2>>[s:3]1[cH:4][cH:5][c:6]2[c:7]1[cH:8][cH:9][c:10]([CH2:12][CH2:13][O:14][CH2:22][CH2:23][CH2:24][N:25]1[CH2:26][CH:27]([O:29][C:30]([c:31]3[cH:32][cH:33][cH:34][cH:35][cH:36]3)([c:37]3[cH:38][cH:39][cH:40][cH:41][cH:42]3)[c:43]3[cH:44][cH:45][cH:46][cH:47][cH:48]3)[CH2:28]1)[cH:11]2
참가 물질출처 및 근거반응 노트

참가 물질

10

반응물 9

HCID 259Bromide ionHCID 923Sodium IonHCID 961HydroxideHCID 962WaterHCID 971Oxalic AcidHCID 1140TolueneHCID 16028TetrabutylammoniumHCID 119833712-(1-Benzothiophen-5-yl)ethan-1-ol
HCID 21990097
1-(3-Chloropropyl)-3-(trityloxy)azetidine

생성물 1

HCID 219900541-{3-[2-(1-Benzothiophen-5-yl)ethoxy]propyl}-3-(trityloxy)azetidine

출처 및 근거

ORD 기록
ord-90743830117b45cbbb1d8a6819ab8fc2
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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