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Ethylene Glycol → 1-{5-[2-(2-Methyl-1,3-dioxolan-2-yl)ethyl]thiophen-2-yl}ethan-1-one

HRID 1238139
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HRID 1238139 반응식
[C:1]([CH3:2])(=[O:3])[c:4]1[cH:5][cH:6][c:7]([CH2:9][CH2:10][C:11]([CH3:12])=[O:13])[s:8]1.[CH2:39]([Cl:40])[Cl:41].[CH:18]([O:19][CH2:20][CH3:21])([O:22][CH2:23][CH3:24])[O:25][CH2:26][CH3:27].[OH:14][CH2:15][CH2:16][OH:17].[c:28]1([CH3:29])[cH:30][cH:31][c:32]([S:33]([OH:34])(=[O:35])=[O:36])[cH:37][cH:38]1>>[C:1]([CH3:2])(=[O:3])[c:4]1[cH:5][cH:6][c:7]([CH2:9][CH2:10][C:11]2([CH3:12])[O:13][CH2:16][CH2:15][O:14]2)[s:8]1
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참가 물질

6

반응물 5

HCID 174Ethylene GlycolHCID 6101p-Toluenesulfonic acidHCID 6344DichloromethaneHCID 31214Ethyl orthoformateHCID 124033184-(5-Acetylthiophen-2-yl)butan-2-one

생성물 1

HCID 198091711-{5-[2-(2-Methyl-1,3-dioxolan-2-yl)ethyl]thiophen-2-yl}ethan-1-one

출처 및 근거

ORD 기록
ord-e68a919289a54bed80f8946cb404aea4
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

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