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Dichloromethane → 4-[6-(4-Tert-butylcyclohexyl)oxy-5-(trifluoromethyl)naphthalen-2-yl]-4-methyl-1,3-oxazolidin-2-one

HRID 160597
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HRID 160597 반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[CH:5]1[CH2:6][CH2:7][CH:8]([OH:11])[CH2:9][CH2:10]1.[CH2:72]([Cl:73])[Cl:74].[O:53]1[CH2:54][CH2:55][CH2:56][CH2:57]1.[O:58]=[C:59]([O:60][CH:61]([CH3:62])[CH3:63])[N:64]=[N:65][C:66]([O:67][CH:68]([CH3:69])[CH3:70])=[O:71].[OH:12][c:13]1[c:14]([C:30]([F:31])([F:32])[F:33])[c:15]2[cH:16][cH:17][c:18]([C:23]3([CH3:29])[NH:24][C:25](=[O:28])[O:26][CH2:27]3)[cH:19][c:20]2[cH:21][cH:22]1.[c:34]1([P:35]([c:36]2[cH:37][cH:38][cH:39][cH:40][cH:41]2)[c:42]2[cH:43][cH:44][cH:45][cH:46][cH:47]2)[cH:48][cH:49][cH:50][cH:51][cH:52]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[CH:5]1[CH2:6][CH2:7][CH:8]([O:11][c:13]2[c:14]([C:30]([F:31])([F:32])[F:33])[c:15]3[cH:16][cH:17][c:18]([C:23]4([CH3:29])[NH:24][C:25](=[O:28])[O:26][CH2:27]4)[cH:19][c:20]3[cH:21][cH:22]2)[CH2:9][CH2:10]1
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 6344DichloromethaneHCID 73914-tert-ButylcyclohexanolHCID 8028TetrahydrofuranHCID 11776TriphenylphosphineHCID 75555Diisopropyl diazene-1,2-dicarboxylateHCID 674139254-[6-Hydroxy-5-(trifluoromethyl)naphthalen-2-yl]-4-methyl-1,3-oxazolidin-2-one

생성물 1

HCID 67414066
4-[6-(4-Tert-butylcyclohexyl)oxy-5-(trifluoromethyl)naphthalen-2-yl]-4-methyl-1,3-oxazolidin-2-one

출처 및 근거

ORD 기록
ord-44da2f12a73b443bb710b94d97f97239
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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