Toluene → HCID 178435566, 화합물

HRID 145767노트

반응식

[Br:1][c:2]1[cH:3][c:4]2[c:5]([O:18][CH:19]3[CH2:20][CH:21]([C:31](=[O:32])[O:33][CH3:34])[N:22]([C:24](=[O:25])[O:26][C:27]([CH3:28])([CH3:29])[CH3:30])[CH2:23]3)[cH:6][c:7](-[c:12]3[cH:13][cH:14][cH:15][cH:16][cH:17]3)[n:8][c:9]2[cH:10][cH:11]1.[CH3:50][c:51]1[cH:52][cH:53][cH:54][cH:55][cH:56]1.[CH:35](=[CH2:36])[Sn:37]([CH2:38][CH2:39][CH2:40][CH3:41])([CH2:42][CH2:43][CH2:44][CH3:45])[CH2:46][CH2:47][CH2:48][CH3:49]>>[c:2]1([CH:35]=[CH2:36])[cH:3][c:4]2[c:5]([O:18][CH:19]3[CH2:20][CH:21]([C:31](=[O:32])[O:33][CH3:34])[N:22]([C:24](=[O:25])[O:26][C:27]([CH3:28])([CH3:29])[CH3:30])[CH2:23]3)[cH:6][c:7](-[c:12]3[cH:13][cH:14][cH:15][cH:16][cH:17]3)[n:8][c:9]2[cH:10][cH:11]1

참가 물질

반응물 3

HCID 1140Toluene

HCID 81998Tributylvinyltin

HCID 178498490HCID 178498490, 화합물

생성물 1

HCID 178435566HCID 178435566, 화합물

출처 및 근거

ORD 기록: ord-6b380f634fdd46048a3b826c0733be5f
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

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