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Ethanol → 1-({4-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl}methyl)-1H-pyrazole-4-carboxylic acid

HRID 2122983
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HRID 2122983 반응식
[CH3:27][CH2:28][OH:29].[F:1][C:2]([c:3]1[cH:4][c:5](-[c:9]2[n:10][c:11]([CH2:14][n:15]3[n:16][cH:17][c:18]([C:20](=[O:21])[O:22][CH2:23][CH3:24])[cH:19]3)[s:12][cH:13]2)[cH:6][cH:7][cH:8]1)([F:25])[F:26].[Na+:31].[O:32]1[CH2:33][CH2:34][CH2:35][CH2:36]1.[OH-:30]>>[F:1][C:2]([c:3]1[cH:4][c:5](-[c:9]2[n:10][c:11]([CH2:14][n:15]3[n:16][cH:17][c:18]([C:20](=[O:21])[OH:22])[cH:19]3)[s:12][cH:13]2)[cH:6][cH:7][cH:8]1)([F:25])[F:26]
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반응물 5

HCID 702EthanolHCID 923Sodium IonHCID 961HydroxideHCID 8028TetrahydrofuranHCID 66939193ethyl 1-({4-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl}methyl)-1H-pyrazole-4-carboxylate

생성물 1

HCID 442538511-({4-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl}methyl)-1H-pyrazole-4-carboxylic acid

출처 및 근거

ORD 기록
ord-425f82b0dbe0459da796fdb5e6dbde32
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI
10.1039/C8SC04228D

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