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1,2-Dichloroethane → Ethyl (3-bromo-4-((1-isoquinolinylcarbonyl)amino)phenyl)acetate

HRID 112489
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인쇄 미리보기

반응식

HRID 112489 반응식
[CH2:38]([Cl:39])[CH2:40][Cl:41].[CH3:48][N:49]([c:50]1[cH:51][cH:52][n:53][cH:54][cH:55]1)[CH3:56].[ClH:42].[NH2:14][c:15]1[c:16]([Br:27])[cH:17][c:18]([CH2:21][C:22](=[O:23])[O:24][CH2:25][CH3:26])[cH:19][cH:20]1.[O:43]=[CH:44][N:45]([CH3:46])[CH3:47].[OH2:57].[OH:28][n:29]1[c:30]2[c:31]([cH:32][cH:33][cH:34][cH:35]2)[n:36][n:37]1.[c:1]1([C:11](=[O:12])[OH:13])[n:2][cH:3][cH:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]12>>[c:1]1([C:11](=[O:13])[NH:14][c:15]2[c:16]([Br:27])[cH:17][c:18]([CH2:21][C:22](=[O:23])[O:24][CH2:25][CH3:26])[cH:19][cH:20]2)[n:2][cH:3][cH:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]12
참가 물질출처 및 근거반응 노트

참가 물질

9

반응물 8

HCID 111,2-DichloroethaneHCID 313Hydrochloric AcidHCID 962WaterHCID 6228DimethylformamideHCID 142844-(Dimethylamino)pyridineHCID 68092Isoquinoline-1-carboxylic acidHCID 757711-Hydroxybenzotriazole
HCID 19702145
Ethyl 2-(4-amino-3-bromophenyl)acetate

생성물 1

HCID 58778618Ethyl (3-bromo-4-((1-isoquinolinylcarbonyl)amino)phenyl)acetate

출처 및 근거

ORD 기록
ord-ea63c53359044394b925d2c21bf25568
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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