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Chloride → 2-Fluoro-3-hydroxy-6-[4-(4-octyloxyphenyl)phenyl]pyridine

HRID 2349099
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HRID 2349099 반응식
[B:37]([O:38][CH:47]([CH3:48])[CH3:49])([O:39][CH:40]([CH3:41])[CH3:42])[O:43][CH:44]([CH3:45])[CH3:46].[CH2:53]([c:54]1[cH:55][cH:56][cH:57][cH:58][cH:59]1)[CH3:60].[CH3:61][CH2:62][CH2:63][CH2:64][CH2:65][CH3:66].[CH:1]([N-:2][CH:3]([CH3:4])[CH3:5])([CH3:6])[CH3:7].[Cl-:52].[ClH:50].[F:9][c:10]1[n:11][c:12](-[c:16]2[cH:17][cH:18][c:19](-[c:22]3[cH:23][cH:24][c:25]([O:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH3:36])[cH:26][cH:27]3)[cH:20][cH:21]2)[cH:13][cH:14][cH:15]1.[Li+:8].[Na+:51].[O:67]1[CH2:68][CH2:69][CH2:70][CH2:71]1.[O:72]1[CH2:73][CH2:74][CH2:75][CH2:76]1>>[F:9][c:10]1[n:11][c:12](-[c:16]2[cH:17][cH:18][c:19](-[c:22]3[cH:23][cH:24][c:25]([O:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH3:36])[cH:26][cH:27]3)[cH:20][cH:21]2)[cH:13][cH:14][c:15]1[OH:38]
참가 물질출처 및 근거반응 노트

참가 물질

11

반응물 10

HCID 312ChlorideHCID 313Hydrochloric AcidHCID 923Sodium IonHCID 7500EthylbenzeneHCID 8028Tetrahydrofuran2회HCID 8058HexaneHCID 21531Triisopropyl borateHCID 28486Lithium Cation
HCID 5062348Diisopropylamide
HCID 190469542-Fluoro-6-[4-(4-octyloxyphenyl)phenyl]pyridine

생성물 1

HCID 190469362-Fluoro-3-hydroxy-6-[4-(4-octyloxyphenyl)phenyl]pyridine

출처 및 근거

ORD 기록
ord-c11409180f7b41a2bcbe458b2053e285
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

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