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Hydrochloric Acid → 3-Cyano-1-(2,6-dichloro-4-trifluoromethylphenyl)-5-(1-hydroxy-2,2,2-trifluoroethyl)-4-trifluoromethylthiopyrazole

HRID 96006
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HRID 96006 반응식
[C:1](#[N:2])[c:3]1[n:4][n:5](-[c:15]2[c:16]([Cl:26])[cH:17][c:18]([C:22]([F:23])([F:24])[F:25])[cH:19][c:20]2[Cl:21])[c:6]([CH:13]=[O:14])[c:7]1[S:8][C:9]([F:10])([F:11])[F:12].[CH2:36]([N+:37]([CH2:38][CH2:39][CH2:40][CH3:41])([CH2:42][CH2:43][CH2:44][CH3:45])[CH2:46][CH2:47][CH2:48][CH3:49])[CH2:50][CH2:51][CH3:52].[ClH:53].[F-:35].[F:27][C:28]([F:29])([F:30])[Si:31]([CH3:32])([CH3:33])[CH3:34].[O:54]1[CH2:55][CH2:56][CH2:57][CH2:58]1>>[C:1](#[N:2])[c:3]1[n:4][n:5](-[c:15]2[c:16]([Cl:26])[cH:17][c:18]([C:22]([F:23])([F:24])[F:25])[cH:19][c:20]2[Cl:21])[c:6]([CH:13]([OH:14])[C:28]([F:27])([F:29])[F:30])[c:7]1[S:8][C:9]([F:10])([F:11])[F:12]
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 313Hydrochloric AcidHCID 8028TetrahydrofuranHCID 16028TetrabutylammoniumHCID 28179Fluoride IonHCID 552549(Trifluoromethyl)trimethylsilaneHCID 118120983-Cyano-1-(2,6-dichloro-4-trifluoromethylphenyl)-5-formyl-4-trifluoromethylthiopyrazole

생성물 1

HCID 9827450
3-Cyano-1-(2,6-dichloro-4-trifluoromethylphenyl)-5-(1-hydroxy-2,2,2-trifluoroethyl)-4-trifluoromethylthiopyrazole

출처 및 근거

ORD 기록
ord-48da9669fa624e9f9dc36108d03a441b
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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