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Hydrochloric Acid → 3-Dimethylaminopropyl 4-[3-(3-acetoxy-4-acetyl-2-propylphenoxy)propoxy]-3-bromobenzoate

HRID 122848
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HRID 122848 반응식
[Br:23][c:24]1[cH:25][c:26]([C:27](=[O:28])[O:29][CH2:30][CH2:31][CH2:32][N:33]([CH3:34])[CH3:35])[cH:36][cH:37][c:38]1[OH:39].[C:1]([CH3:2])(=[O:3])[O:4][c:5]1[c:6]([CH2:19][CH2:20][CH3:21])[c:7]([O:8][CH2:9][CH2:10][CH2:11][Br:12])[cH:13][cH:14][c:15]1[C:16]([CH3:17])=[O:18].[C:42](=[O:43])([O-:44])[O-:45].[CH3:48][N:49]([CH3:50])[CH:51]=[O:52].[ClH:22].[I-:41].[K+:40].[K+:46].[K+:47]>>[C:1]([CH3:2])(=[O:3])[O:4][c:5]1[c:6]([CH2:19][CH2:20][CH3:21])[c:7]([O:8][CH2:9][CH2:10][CH2:11][O:39][c:38]2[c:24]([Br:23])[cH:25][c:26]([C:27](=[O:28])[O:29][CH2:30][CH2:31][CH2:32][N:33]([CH3:34])[CH3:35])[cH:36][cH:37]2)[cH:13][cH:14][c:15]1[C:16]([CH3:17])=[O:18]
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 313Hydrochloric AcidHCID 813Potassium Cation3회HCID 6228DimethylformamideHCID 19660Carbonate IonHCID 30165Iodide IonHCID 201570243-(3-Acetoxy-4-acetyl-2-propylphenoxy)propylbromideHCID 201570263-(Dimethylamino)propyl 3-bromo-4-hydroxybenzoate

생성물 1

HCID 137456293-Dimethylaminopropyl 4-[3-(3-acetoxy-4-acetyl-2-propylphenoxy)propoxy]-3-bromobenzoate

출처 및 근거

ORD 기록
ord-1919af1ca1f041c489b31af4a70c41c6
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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