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Acetone → 2-Hydroxy-5-[6-[2,3-bis(phenylmethoxy)phenyl]hexyloxy]benzoic acid methyl ester

HRID 1147644
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HRID 1147644 반응식
[C:42](=[O:43])([O-:44])[O-:45].[CH3:30][O:31][C:32]([c:33]1[c:34]([OH:40])[cH:35][cH:36][c:37]([OH:39])[cH:38]1)=[O:41].[CH3:48][C:49](=[O:50])[CH3:51].[I:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][c:8]1[c:9]([O:22][CH2:23][c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)[c:10]([O:14][CH2:15][c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[cH:11][cH:12][cH:13]1.[K+:46].[K+:47]>>[CH2:2]([CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][c:8]1[c:9]([O:22][CH2:23][c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)[c:10]([O:14][CH2:15][c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[cH:11][cH:12][cH:13]1)[O:39][c:37]1[cH:36][cH:35][c:34]([OH:40])[c:33]([C:32]([O:31][CH3:30])=[O:41])[cH:38]1
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 180AcetoneHCID 813Potassium Cation2회HCID 19660Carbonate IonHCID 75077Methyl GentisateHCID 149862851-(6-Iodohexyl)-2,3-bis(phenylmethoxy)benzene

생성물 1

HCID 149863412-Hydroxy-5-[6-[2,3-bis(phenylmethoxy)phenyl]hexyloxy]benzoic acid methyl ester

출처 및 근거

ORD 기록
ord-5443e00f9aef4c1a918cb0a8e80ca019
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

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