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Dichloromethane → [4-(4-Ethanesulfonyl-piperazine-1-carbonyl)-6-fluoro-3-methyl-naphthalen-2-yl]-acetic acid methyl ester

HRID 1229304
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인쇄 미리보기

반응식

HRID 1229304 반응식
[CH2:33]([CH3:34])[S:35](=[O:36])(=[O:37])[Cl:38].[CH3:39][CH2:40][N:41]([CH2:42][CH3:43])[CH2:44][CH3:45].[CH3:8][O:9][C:10]([CH2:11][c:12]1[cH:13][c:14]2[cH:15][cH:16][c:17]([F:31])[cH:18][c:19]2[c:20]([C:23](=[O:24])[N:25]2[CH2:26][CH2:27][NH:28][CH2:29][CH2:30]2)[c:21]1[CH3:22])=[O:32].[Cl:46][CH2:47][Cl:48].[F:1][C:2]([F:3])([F:4])[C:5]([OH:6])=[O:7]>>[CH3:8][O:9][C:10]([CH2:11][c:12]1[cH:13][c:14]2[cH:15][cH:16][c:17]([F:31])[cH:18][c:19]2[c:20]([C:23](=[O:24])[N:25]2[CH2:26][CH2:27][N:28]([S:35]([CH2:33][CH3:34])(=[O:36])=[O:37])[CH2:29][CH2:30]2)[c:21]1[CH3:22])=[O:32]
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 8471TriethylamineHCID 11667Ethanesulfonyl chlorideHCID 59326724Methyl 2-[6-fluoro-3-methyl-4-(piperazine-1-carbonyl)naphthalen-2-yl]acetate

생성물 1

HCID 59326736[4-(4-Ethanesulfonyl-piperazine-1-carbonyl)-6-fluoro-3-methyl-naphthalen-2-yl]-acetic acid methyl ester

출처 및 근거

ORD 기록
ord-231141e4f5974db5899bb08afd2f4001
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

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