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Hydrochloric Acid → 2-[3-(3,4,5-Trichlorophenyl)-3-(trifluoromethyl)-pyrrolidin-1-yl]-4-(trifluoromethyl)-1,3-thiazole-5-carboxylic acid

HRID 154480
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HRID 154480 반응식
[CH2:33]1[O:34][CH2:35][CH2:36][O:37][CH2:38]1.[Cl:1][c:2]1[cH:3][c:4]([C:10]2([C:29]([F:30])([F:31])[F:32])[CH2:11][N:12]([c:15]3[s:16][c:17]([C:24](=[O:25])[O:26][CH2:27][CH3:28])[c:18]([C:20]([F:21])([F:22])[F:23])[n:19]3)[CH2:13][CH2:14]2)[cH:5][c:6]([Cl:9])[c:7]1[Cl:8].[ClH:41].[Na+:40].[OH-:39].[OH2:42]>>[Cl:1][c:2]1[cH:3][c:4]([C:10]2([C:29]([F:30])([F:31])[F:32])[CH2:11][N:12]([c:15]3[s:16][c:17]([C:24](=[O:25])[OH:26])[c:18]([C:20]([F:21])([F:22])[F:23])[n:19]3)[CH2:13][CH2:14]2)[cH:5][c:6]([Cl:9])[c:7]1[Cl:8]
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HCID 313Hydrochloric AcidHCID 923Sodium IonHCID 961HydroxideHCID 962WaterHCID 312751,4-DioxaneHCID 59453365Ethyl 2-[3-(3,4,5-trichlorophenyl)-3-(trifluoro-methyl)pyrrolidin-1-yl]-4-(trifluoromethyl)-1,3-thiazole-5-carboxylate

생성물 1

HCID 59453366
2-[3-(3,4,5-Trichlorophenyl)-3-(trifluoromethyl)-pyrrolidin-1-yl]-4-(trifluoromethyl)-1,3-thiazole-5-carboxylic acid

출처 및 근거

ORD 기록
ord-45895ddf5f6c48efbb47dd5d5b49f158
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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