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Hydrochloric Acid → 2-[2-(2-Chloro-phenoxy)-3-ethoxycarbonyl-allylamino]-5,5,5-trifluoro-4-trifluoromethyl-pentanoic acid methyl ester

HRID 2321165
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인쇄 미리보기

반응식

HRID 2321165 반응식
[CH2:27]([CH3:28])[O:29][C:30]([CH:31]=[C:32]([CH2:33][Br:34])[O:35][c:36]1[c:37]([Cl:42])[cH:38][cH:39][cH:40][cH:41]1)=[O:43].[CH3:2][O:3][C:4]([CH:5]([CH2:6][CH:7]([C:8]([F:9])([F:10])[F:11])[C:12]([F:13])([F:14])[F:15])[NH2:16])=[O:17].[CH3:44][C:45]#[N:46].[CH:18]([N:19]([CH2:20][CH3:21])[CH:22]([CH3:23])[CH3:24])([CH3:25])[CH3:26].[ClH:1]>>[CH3:2][O:3][C:4]([CH:5]([CH2:6][CH:7]([C:8]([F:9])([F:10])[F:11])[C:12]([F:13])([F:14])[F:15])[NH:16][CH2:33][C:32](=[CH:31][C:30]([O:29][CH2:27][CH3:28])=[O:43])[O:35][c:36]1[c:37]([Cl:42])[cH:38][cH:39][cH:40][cH:41]1)=[O:17]
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 313Hydrochloric AcidHCID 6342AcetonitrileHCID 81531DiisopropylethylamineHCID 53395680HCID 53395680, 화합물HCID 66893618Ethyl 4-bromo-3-(2-chlorophenoxy)but-2-enoate

생성물 1

HCID 866352382-[2-(2-Chloro-phenoxy)-3-ethoxycarbonyl-allylamino]-5,5,5-trifluoro-4-trifluoromethyl-pentanoic acid methyl ester

출처 및 근거

ORD 기록
ord-12f7486f300f4dae92a8413ddeea13e2
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

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