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Acetate → 4'-[(4-Butyl-2-methyl-6-oxo-1-phenyl-1,6-dihydropyrimidin-5-yl)methyl]-3',5'-difluorobiphenyl-2-carbonitrile

HRID 830648
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HRID 830648 반응식
[C:61]([O-:62])(=[O:63])[CH3:64].[C:66]([O-:67])(=[O:68])[CH3:69].[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[n:6][c:7]([CH3:29])[nH:8][c:9](=[O:28])[c:10]1[CH2:11][c:12]1[c:13]([F:27])[cH:14][c:15](-[c:19]2[c:20]([C:25]#[N:26])[cH:21][cH:22][cH:23][cH:24]2)[cH:16][c:17]1[F:18].[CH2:52]([Cl:53])[Cl:54].[CH3:39][CH2:40][N:41]([CH2:42][CH3:43])[CH2:44][CH3:45].[CH3:55][CH2:56][O:57][C:58](=[O:59])[CH3:60].[Cu+2:65].[OH:30][B:31]([OH:32])[c:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1.[cH:46]1[cH:47][cH:48][n:49][cH:50][cH:51]1>>[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[n:6][c:7]([CH3:29])[n:8](-[c:33]2[cH:34][cH:35][cH:36][cH:37][cH:38]2)[c:9](=[O:28])[c:10]1[CH2:11][c:12]1[c:13]([F:27])[cH:14][c:15](-[c:19]2[c:20]([C:25]#[N:26])[cH:21][cH:22][cH:23][cH:24]2)[cH:16][c:17]1[F:18]
참가 물질출처 및 근거반응 노트

참가 물질

9

반응물 8

HCID 175Acetate2회HCID 1049PyridineHCID 6344DichloromethaneHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 27099Cupric cationHCID 66827Phenylboronic Acid
HCID 136146822
4'-[(4-Butyl-2-methyl-6-oxo-1,6-dihydropyrimidin-5-yl)methyl]-3',5'-difluorobiphenyl-2-carbonitrile

생성물 1

HCID 574605434'-[(4-Butyl-2-methyl-6-oxo-1-phenyl-1,6-dihydropyrimidin-5-yl)methyl]-3',5'-difluorobiphenyl-2-carbonitrile

출처 및 근거

ORD 기록
ord-b5842e30d9414f9284e2ce9932e53c5e
출처 데이터셋
Test data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

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