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Hydrochloric Acid → Hydrochloric Acid

HRID 101353
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인쇄 미리보기

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HRID 101353 반응식
[CH2:44]([N:45]=[C:46]=[N:47][CH2:48][CH2:49][CH2:50][N:51]([CH3:52])[CH3:53])[CH3:54].[CH2:66]1[O:67][CH2:68][CH2:69][CH2:70]1.[CH3:1][O:2][c:3]1[c:4]2[c:8]([c:9]([O:16][CH3:17])[c:10]([O:14][CH3:15])[c:11]1[O:12][CH3:13])[CH2:7][CH:6]([CH2:18][CH2:19][CH2:20][O:21][c:22]1[cH:23][cH:24][c:25]([C:26](=[O:27])[OH:28])[cH:29][cH:30]1)[CH2:5]2.[CH3:72][CH2:73][N:74]([CH2:75][CH3:76])[CH2:77][CH3:78].[ClH:43].[N:31]1([CH:37]2[CH2:38][CH2:39][NH:40][CH2:41][CH2:42]2)[CH2:32][CH2:33][CH2:34][CH2:35][CH2:36]1.[OH2:55].[OH2:71].[OH:56][n:57]1[c:58]2[cH:59][cH:60][cH:61][cH:62][c:63]2[n:64][n:65]1>>[CH3:1][O:2][c:3]1[c:4]2[c:8]([c:9]([O:16][CH3:17])[c:10]([O:14][CH3:15])[c:11]1[O:12][CH3:13])[CH2:7][CH:6]([CH2:18][CH2:19][CH2:20][O:21][c:22]1[cH:23][cH:24][c:25]([C:26](=[O:28])[N:40]3[CH2:39][CH2:38][CH:37]([N:31]4[CH2:32][CH2:33][CH2:34][CH2:35][CH2:36]4)[CH2:42][CH2:41]3)[cH:29][cH:30]1)[CH2:5]2.[ClH:43]
참가 물질출처 및 근거반응 노트

참가 물질

10

반응물 8

HCID 313Hydrochloric AcidHCID 962Water2회HCID 8028TetrahydrofuranHCID 8471TriethylamineHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 757711-HydroxybenzotriazoleHCID 786071,4'-Bipiperidine
HCID 18348551
4-[3-(4,5,6,7-Tetramethoxyindan-2-yl)propoxy]benzoic acid

생성물 2

HCID 313Hydrochloric AcidHCID 18348535(4-piperidin-1-ylpiperidin-1-yl)-[4-[3-(4,5,6,7-tetramethoxy-2,3-dihydro-1H-inden-2-yl)propoxy]phenyl]methanone

출처 및 근거

ORD 기록
ord-3d3664f8e8fb4e8abfa747366a141e03
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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