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Benzene → 1-Phenyl-3-methyl-4-(3,4-dichlorophenylcarbamoyl)-2-pyrazolin-5-one

HRID 105365
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인쇄 미리보기

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HRID 105365 반응식
[CH3:14][CH2:15][N:16]([CH2:17][CH3:18])[CH2:19][CH3:20].[Cl:21][c:22]1[cH:23][c:24]([N:29]=[C:30]=[O:31])[cH:25][cH:26][c:27]1[Cl:28].[c:1]1([N:7]2[N:8]=[C:9]([CH3:13])[CH2:10][C:11]2=[O:12])[cH:2][cH:3][cH:4][cH:5][cH:6]1.[cH:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1>>[c:1]1([N:7]2[N:8]=[C:9]([CH3:13])[CH:10]([C:30]([NH:29][c:24]3[cH:23][c:22]([Cl:21])[c:27]([Cl:28])[cH:26][cH:25]3)=[O:31])[C:11]2=[O:12])[cH:2][cH:3][cH:4][cH:5][cH:6]1
참가 물질출처 및 근거반응 노트

참가 물질

5

반응물 4

HCID 241BenzeneHCID 4021Mci-186HCID 76073,4-Dichlorophenyl isocyanateHCID 8471Triethylamine

생성물 1

HCID 203354391-Phenyl-3-methyl-4-(3,4-dichlorophenylcarbamoyl)-2-pyrazolin-5-one

출처 및 근거

ORD 기록
ord-cc339f9e51c1459885875036b2047702
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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