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Acetate → N-(4'-bromo-[1,1'-biphenyl]-4-yl)-N-phenylnaphthalen-1-amine

HRID 92712
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HRID 92712 반응식
[Br:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[cH:9][cH:10][c:11]([Br:14])[cH:12][cH:13]2)[cH:6][cH:7]1.[CH3:32][C:33]([CH3:34])([O-:35])[CH3:36].[CH3:38][c:39]1[cH:40][cH:41][cH:42][cH:43][cH:44]1.[Fe+2:90].[Na+:37].[O-:46][C:47]([CH3:48])=[O:49].[O-:50][C:51]([CH3:52])=[O:53].[Pd+2:45].[c:15]1([NH:25][c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[cH:16][cH:17][cH:18][c:19]2[cH:20][cH:21][cH:22][cH:23][c:24]12.[cH:54]1[cH:55][cH:56][c:57]([P:58]([c:59]2[cH:60][cH:61][cH:62][cH:63][cH:64]2)[c-:65]2[cH:66][cH:67][cH:68][cH:69]2)[cH:70][cH:71]1.[cH:72]1[cH:73][cH:74][c:75]([P:76]([c:77]2[cH:78][cH:79][cH:80][cH:81][cH:82]2)[c-:83]2[cH:84][cH:85][cH:86][cH:87]2)[cH:88][cH:89]1>>[c:2]1([N:25]([c:15]2[cH:16][cH:17][cH:18][c:19]3[cH:20][cH:21][cH:22][cH:23][c:24]23)[c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[cH:3][cH:4][c:5](-[c:8]2[cH:9][cH:10][c:11]([Br:14])[cH:12][cH:13]2)[cH:6][cH:7]1
참가 물질출처 및 근거반응 노트

참가 물질

10

반응물 9

HCID 175Acetate2회HCID 923Sodium IonHCID 1140TolueneHCID 7013Phenyl-1-naphthylamineHCID 71104,4'-DibromobiphenylHCID 27284Ferrous cationHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)
HCID 4574913
2-Methylpropan-2-olate
HCID 178420532HCID 178420532, 화합물2회

생성물 1

HCID 16755312N-(4'-bromo-[1,1'-biphenyl]-4-yl)-N-phenylnaphthalen-1-amine

출처 및 근거

ORD 기록
ord-10c07d7ffef84ceeb08739008716f3ca
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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