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Hydrochloric Acid → 4-(1-cyclohexyl-3-ethyl-1H-indazol-6-yl)-4-hydroxy-cyclohexanecarboxylic acid ethyl ester

HRID 2138545
노트
인쇄 미리보기

반응식

HRID 2138545 반응식
[Br:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([CH2:17][CH3:18])[n:7][n:8]([CH:11]3[CH2:12][CH2:13][CH2:14][CH2:15][CH2:16]3)[c:9]2[cH:10]1.[CH2:24]([Li:25])[CH2:26][CH2:27][CH3:28].[CH2:29]([CH3:30])[O:31][C:32](=[O:33])[CH:34]1[CH2:35][CH2:36][C:37](=[O:40])[CH2:38][CH2:39]1.[CH3:42][c:43]1[cH:44][cH:45][cH:46][cH:47][cH:48]1.[ClH:41].[O:19]1[CH2:20][CH2:21][CH2:22][CH2:23]1>>[c:2]1([C:37]2([OH:40])[CH2:36][CH2:35][CH:34]([C:32]([O:31][CH2:29][CH3:30])=[O:33])[CH2:39][CH2:38]2)[cH:3][cH:4][c:5]2[c:6]([CH2:17][CH3:18])[n:7][n:8]([CH:11]3[CH2:12][CH2:13][CH2:14][CH2:15][CH2:16]3)[c:9]2[cH:10]1
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 313Hydrochloric AcidHCID 1140TolueneHCID 8028TetrahydrofuranHCID 317638Ethyl 4-oxocyclohexanecarboxylateHCID 118089646-Bromo-1-cyclohexyl-3-ethyl-1H-indazoleHCID 178418339Butyllithium

생성물 1

HCID 11025740
4-(1-cyclohexyl-3-ethyl-1H-indazol-6-yl)-4-hydroxy-cyclohexanecarboxylic acid ethyl ester

출처 및 근거

ORD 기록
ord-a1b170ca7a46453699ada2a1e787c832
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI
10.1039/C8SC04228D

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