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Citric Acid → 1-[2-(1,3-Dioxolan-2-yl)-1,3-thiazol-5-yl]-2,2,2-trifluoroethanol

HRID 160548
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HRID 160548 반응식
[CH2:17]([Li:18])[CH2:19][CH2:20][CH3:21].[CH3:11][CH2:12][CH2:13][CH2:14][CH2:15][CH3:16].[F:22][C:23]([C:24](=[O:25])[O:26][CH2:27][CH3:28])([F:29])[F:30].[O:1]1[CH:2]([c:6]2[s:7][cH:8][cH:9][n:10]2)[O:3][CH2:4][CH2:5]1.[O:44]1[CH2:45][CH2:46][CH2:47][CH2:48]1.[OH:31][C:32]([CH2:33][C:34]([C:35](=[O:36])[OH:37])([CH2:38][C:39](=[O:40])[OH:41])[OH:42])=[O:43]>>[O:1]1[CH:2]([c:6]2[s:7][c:8]([CH:24]([C:23]([F:22])([F:29])[F:30])[OH:25])[cH:9][n:10]2)[O:3][CH2:4][CH2:5]1
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7

반응물 6

HCID 311Citric AcidHCID 8028TetrahydrofuranHCID 8058HexaneHCID 9794Ethyl trifluoroacetateHCID 152051582-(1,3-Dioxolan-2-yl)-1,3-thiazoleHCID 178418339Butyllithium

생성물 1

HCID 593313011-[2-(1,3-Dioxolan-2-yl)-1,3-thiazol-5-yl]-2,2,2-trifluoroethanol

출처 및 근거

ORD 기록
ord-78457b1947d447148f73a38b21700c8d
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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