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Tetrahydrofuran → t-Butyl 1,4-dioxepan-6-yl(1,3-dioxoisoindolin-2-yl)carbamate

HRID 303771
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HRID 303771 반응식
[CH2:59]1[O:60][CH2:61][CH2:62][CH2:63]1.[O:13]1[CH2:14][CH2:15][O:16][CH2:17][CH:18]([OH:20])[CH2:19]1.[O:1]=[C:2]([O:3][CH2:4][CH3:5])[N:6]=[N:7][C:8]([O:9][CH2:10][CH3:11])=[O:12].[O:21]=[C:22]1[N:23]([NH:32][C:33]([O:34][C:35]([CH3:36])([CH3:37])[CH3:38])=[O:39])[C:24](=[O:31])[c:25]2[cH:26][cH:27][cH:28][cH:29][c:30]21.[c:40]1([P:41]([c:42]2[cH:43][cH:44][cH:45][cH:46][cH:47]2)[c:48]2[cH:49][cH:50][cH:51][cH:52][cH:53]2)[cH:54][cH:55][cH:56][cH:57][cH:58]1>>[O:13]1[CH2:14][CH2:15][O:16][CH2:17][CH:18]([N:32]([N:23]2[C:22](=[O:21])[c:30]3[c:25]([cH:26][cH:27][cH:28][cH:29]3)[C:24]2=[O:31])[C:33]([O:34][C:35]([CH3:36])([CH3:37])[CH3:38])=[O:39])[CH2:19]1
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 8028TetrahydrofuranHCID 11776TriphenylphosphineHCID 220568ethyl N-ethoxycarbonyliminocarbamateHCID 801162N-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)(tert-butoxy)formamideHCID 137159861,4-Dioxepan-6-ol

생성물 1

HCID 86686321t-Butyl 1,4-dioxepan-6-yl(1,3-dioxoisoindolin-2-yl)carbamate

출처 및 근거

ORD 기록
ord-b387cc31b342438ea829c72da81c4a85
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

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