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Chloride → trans-4-(2-(trans-4-(3,4-Difluorophenyl) cyclohexyl) ethyl)-1-(3-methylbutyl)-1-silacyclohexane

HRID 297389
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HRID 297389 반응식
[CH2:54]([Zn+:55])[CH2:56][CH2:57][CH2:58][CH3:59].[CH3:25][CH:26]([CH2:27][CH2:28][Zn+:29])[CH3:30].[Cl-:24].[Cl-:53].[Cl:1][SiH:2]1[CH2:3][CH2:4][CH:5]([CH2:8][CH2:9][CH:10]2[CH2:11][CH2:12][CH:13]([c:16]3[cH:17][c:18]([F:23])[c:19]([F:22])[cH:20][cH:21]3)[CH2:14][CH2:15]2)[CH2:6][CH2:7]1.[Cl:31][SiH:32]1[CH2:33][CH2:34][CH:35]([CH2:36][CH2:37][CH:38]2[CH2:39][CH2:40][CH:41]([c:42]3[cH:43][cH:44][c:45]([F:46])[cH:47][cH:48]3)[CH2:49][CH2:50]2)[CH2:51][CH2:52]1>>[SiH:2]1([CH2:28][CH2:27][CH:26]([CH3:25])[CH3:30])[CH2:3][CH2:4][CH:5]([CH2:8][CH2:9][CH:10]2[CH2:11][CH2:12][CH:13]([c:16]3[cH:17][c:18]([F:23])[c:19]([F:22])[cH:20][cH:21]3)[CH2:14][CH2:15]2)[CH2:6][CH2:7]1
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참가 물질

6

반응물 5

HCID 312Chloride2회HCID 1231362111-Chloro-4-(2-(trans-4-(p-fluorophenyl)cyclohexyl)ethyl)-1-silacyclohexaneHCID 1317194941-Chloro-4-(2-(trans-4-(3,4-difluorophenyl)cyclohexyl)ethyl)-1-silacyclohexaneHCID 178445877HCID 178445877, 화합물HCID 178445879HCID 178445879, 화합물

생성물 1

HCID 67578773
trans-4-(2-(trans-4-(3,4-Difluorophenyl) cyclohexyl) ethyl)-1-(3-methylbutyl)-1-silacyclohexane

출처 및 근거

ORD 기록
ord-49b900044cf14f18933e6bc7c1ee7f05
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

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