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Hydrochloric Acid → 1-[4-[2-[4-(6-Fluoro-1,2-benzisoxazol-3-yl)1-piperidinyl]ethoxy]-3-methoxyphenyl]ethanone

HRID 113291
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인쇄 미리보기

반응식

HRID 113291 반응식
[CH3:39][N:40]([CH3:41])[CH:42]=[O:43].[Cl:24][CH2:25][CH2:26][O:27][c:28]1[c:29]([O:37][CH3:38])[cH:30][c:31]([C:34]([CH3:35])=[O:36])[cH:32][cH:33]1.[ClH:1].[F:2][c:3]1[cH:4][c:5]2[c:6]([c:7]([CH:10]3[CH2:11][CH2:12][NH:13][CH2:14][CH2:15]3)[n:8][o:9]2)[cH:16][cH:17]1.[K+:18].[K+:19].[O-:20][C:21]([O-:22])=[O:23].[OH2:44]>>[F:2][c:3]1[cH:4][c:5]2[c:6]([c:7]([CH:10]3[CH2:11][CH2:12][N:13]([CH2:25][CH2:26][O:27][c:28]4[c:29]([O:37][CH3:38])[cH:30][c:31]([C:34]([CH3:35])=[O:36])[cH:32][cH:33]4)[CH2:14][CH2:15]3)[n:8][o:9]2)[cH:16][cH:17]1
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 313Hydrochloric AcidHCID 813Potassium Cation2회HCID 962WaterHCID 6228DimethylformamideHCID 19660Carbonate IonHCID 8494213-(4-Piperidyl)-6-fluoro-1,2-benzisoxazoleHCID 144071701-[4-(2-Chloroethoxy)-3-methoxyphenyl]ethanone

생성물

1
HCID 104318121-[4-[2-[4-(6-Fluoro-1,2-benzisoxazol-3-yl)1-piperidinyl]ethoxy]-3-methoxyphenyl]ethanone

출처 및 근거

ORD 기록
ord-2bac45cefe6247c4b8f075fb3498cb65
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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