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Dimethylamine → 5-Amino-1-(2-chloro-6-dimethylamino-4-trifluoromethylphenyl)-3-cyano-4-trifluoromethylsulfonylpyrazole

HRID 1562972
노트
인쇄 미리보기

반응식

HRID 1562972 반응식
[C:31]([O:32][CH2:33][CH3:34])(=[O:35])[CH3:36].[CH3:28][NH:29][CH3:30].[CH3:37][CH2:38][CH2:39][CH2:40][CH2:41][CH2:42][CH3:43].[NH2:1][c:2]1[c:3]([S:21](=[O:22])(=[O:23])[C:24]([F:25])([F:26])[F:27])[c:4]([C:19]#[N:20])[n:5][n:6]1-[c:7]1[c:8]([Cl:18])[cH:9][c:10]([C:14]([F:15])([F:16])[F:17])[cH:11][c:12]1[Cl:13].[O:45]1[CH2:46][CH2:47][O:48][CH2:49][CH2:50]1.[OH2:44]>>[NH2:1][c:2]1[c:3]([S:21](=[O:22])(=[O:23])[C:24]([F:25])([F:26])[F:27])[c:4]([C:19]#[N:20])[n:5][n:6]1-[c:7]1[c:8]([Cl:18])[cH:9][c:10]([C:14]([F:15])([F:16])[F:17])[cH:11][c:12]1[N:29]([CH3:28])[CH3:30]
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 674DimethylamineHCID 962WaterHCID 8857Ethyl AcetateHCID 8900HeptaneHCID 312751,4-DioxaneHCID 3078139Fipronil sulfone

생성물 1

HCID 11488037
5-Amino-1-(2-chloro-6-dimethylamino-4-trifluoromethylphenyl)-3-cyano-4-trifluoromethylsulfonylpyrazole

출처 및 근거

ORD 기록
ord-df142f9ba2b7408590ced882d7b41e25
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

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