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Potassium Cation → 3-Cyanomethoxy-7-[(4,6-dimethoxypyrimidin-2-yl)oxy]-phthalide

HRID 139541
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HRID 139541 반응식
[C:27](=[O:28])([O-:29])[O-:30].[CH3:1][O:2][c:3]1[n:4][c:5]([O:11][c:12]2[cH:13][cH:14][cH:15][c:16]3[c:21]2[C:19](=[O:20])[O:18][CH:17]3[OH:22])[n:6][c:7]([O:9][CH3:10])[cH:8]1.[CH3:53][C:54]([CH2:55][CH3:56])=[O:57].[CH3:58][O:59][C:60]([CH3:61])([CH3:62])[CH3:63].[Cl:23][CH2:24][C:25]#[N:26].[I-:34].[K+:31].[K+:32].[Na+:33].[O:35]1[CH2:36][CH2:37][O:38][CH2:39][CH2:40][O:41][CH2:42][CH2:43][O:44][CH2:45][CH2:46][O:47][CH2:48][CH2:49][O:50][CH2:51][CH2:52]1>>[CH3:1][O:2][c:3]1[n:4][c:5]([O:11][c:12]2[cH:13][cH:14][cH:15][c:16]3[c:21]2[C:19](=[O:20])[O:18][CH:17]3[O:22][CH2:24][C:25]#[N:26])[n:6][c:7]([O:9][CH3:10])[cH:8]1
참가 물질출처 및 근거반응 노트

참가 물질

10

반응물 9

HCID 813Potassium Cation2회HCID 923Sodium IonHCID 6569Methyl Ethyl KetoneHCID 7856ChloroacetonitrileHCID 15413tert-Butyl methyl etherHCID 19660Carbonate IonHCID 2855718-Crown-6HCID 30165
Iodide Ion
HCID 199274177-[(4,6-Dimethoxy-pyrimidin-2-yl)oxy]-3-hydroxy-phthalide

생성물 1

HCID 199274253-Cyanomethoxy-7-[(4,6-dimethoxypyrimidin-2-yl)oxy]-phthalide

출처 및 근거

ORD 기록
ord-0042ca6403604c3a8e0245ca10b7c917
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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