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1-Butanol → 4-[4-(3-Piperidin-1-yl-propoxy)-phenyl]-piperazine-1-carboxylic acid tert-butyl ester

HRID 181512
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인쇄 미리보기

반응식

HRID 181512 반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][N:11]([c:14]2[cH:15][cH:16][c:17]([O:20][CH2:21][CH2:22][CH2:23][Cl:24])[cH:18][cH:19]2)[CH2:12][CH2:13]1.[CH2:25]1[CH2:26][CH2:27][NH:28][CH2:29][CH2:30]1.[CH2:39]([OH:40])[CH2:41][CH2:42][CH3:43].[I-:38].[K+:37].[Na+:31].[Na+:32].[O-:33][C:34](=[O:35])[O-:36]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][N:11]([c:14]2[cH:15][cH:16][c:17]([O:20][CH2:21][CH2:22][CH2:23][N:28]3[CH2:27][CH2:26][CH2:25][CH2:30][CH2:29]3)[cH:18][cH:19]2)[CH2:12][CH2:13]1
참가 물질출처 및 근거반응 노트

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반응물 7

HCID 2631-ButanolHCID 813Potassium CationHCID 923Sodium Ion2회HCID 8082PiperidineHCID 19660Carbonate IonHCID 30165Iodide IonHCID 588178434-[4-(3-Chloro-propoxy)-phenyl]-piperazine-1-carboxylic acid tert-butyl ester

생성물 1

HCID 588178414-[4-(3-Piperidin-1-yl-propoxy)-phenyl]-piperazine-1-carboxylic acid tert-butyl ester

출처 및 근거

ORD 기록
ord-3b8104bc52a5444fbf4885f9050d7d33
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

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