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Chloride → 5-(2,4-Diisobutoxybenzoyl)-2-isobutoxyphenyl acetate

HRID 138970
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HRID 138970 반응식
[Al+3:26].[C:1]([CH3:2])(=[O:3])[O:4][c:5]1[cH:6][c:7]([C:8](=[O:9])[OH:10])[cH:11][cH:12][c:13]1[O:14][CH2:15][CH:16]([CH3:17])[CH3:18].[CH2:29]([CH:30]([CH3:31])[CH3:32])[O:33][c:34]1[cH:35][c:36]([O:40][CH2:41][CH:42]([CH3:43])[CH3:44])[cH:37][cH:38][cH:39]1.[CH2:45]([Cl:46])[Cl:47].[CH3:49][N:50]([CH3:51])[CH:52]=[O:53].[Cl-:25].[Cl-:27].[Cl-:28].[Cl:19][C:20]([C:21]([Cl:22])=[O:23])=[O:24].[OH2:48]>>[C:1]([CH3:2])(=[O:3])[O:4][c:5]1[cH:6][c:7]([C:8](=[O:10])[c:39]2[c:34]([O:33][CH2:29][CH:30]([CH3:31])[CH3:32])[cH:35][c:36]([O:40][CH2:41][CH:42]([CH3:43])[CH3:44])[cH:37][cH:38]2)[cH:11][cH:12][c:13]1[O:14][CH2:15][CH:16]([CH3:17])[CH3:18]
참가 물질출처 및 근거반응 노트

참가 물질

9

반응물 8

HCID 312Chloride3회HCID 962WaterHCID 6228DimethylformamideHCID 6344DichloromethaneHCID 65578Oxalyl chlorideHCID 104727Aluminum CationHCID 130875651,3-Diisobutoxybenzene
HCID 17816473
3-(Acetyloxy)-4-isobutoxybenzoic acid

생성물 1

HCID 178164575-(2,4-Diisobutoxybenzoyl)-2-isobutoxyphenyl acetate

출처 및 근거

ORD 기록
ord-04b7cf7715184a038a658cb02e3f31f1
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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