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Water → Ethyl 3-[4-[3-[heptylcarbamoyl(methyl)amino]phenyl]phenyl]-2-methylprop-2-enoate

HRID 1546702
노트
인쇄 미리보기

반응식

HRID 1546702 반응식
[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH3:7])[N:8]=[C:9]=[O:10].[CH3:11][C:12]([C:13](=[O:14])[O:15][CH2:16][CH3:17])=[CH:18][c:19]1[cH:20][cH:21][c:22](-[c:25]2[cH:26][c:27]([NH:31][CH3:32])[cH:28][cH:29][cH:30]2)[cH:23][cH:24]1.[CH3:33][CH2:34][N:35]([CH2:36][CH3:37])[CH2:38][CH3:39].[CH3:44][CH2:45][O:46][C:47](=[O:48])[CH3:49].[Cl:41][CH2:42][Cl:43].[OH2:40]>>[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH3:7])[NH:8][C:9](=[O:10])[N:31]([c:27]1[cH:26][c:25](-[c:22]2[cH:21][cH:20][c:19]([CH:18]=[C:12]([CH3:11])[C:13](=[O:14])[O:15][CH2:16][CH3:17])[cH:24][cH:23]2)[cH:30][cH:29][cH:28]1)[CH3:32]
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 962WaterHCID 6344DichloromethaneHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 138341n-Heptyl isocyanateHCID 68957155Ethyl 2-methyl-3-(3'-methylaminobiphenyl-4-yl)acrylate

생성물 1

HCID 90990070
Ethyl 3-[4-[3-[heptylcarbamoyl(methyl)amino]phenyl]phenyl]-2-methylprop-2-enoate

출처 및 근거

ORD 기록
ord-9f8d91f8d3b34d66912ae5af767859c9
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

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