Acetate → Triphenylamine

HRID 689761

Reaction equation

HRID 689761 reaction equation
[Br:1][c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1.[CH3:21][C:22]([CH3:23])([O-:24])[CH3:25].[NH:8]([c:9]1[cH:10][cH:11][cH:12][cH:13][cH:14]1)[c:15]1[cH:16][cH:17][cH:18][cH:19][cH:20]1.[Na+:26].[O-:74][C:75]([CH3:76])=[O:77].[O-:78][C:79]([CH3:80])=[O:81].[Pd+2:73].[c:27]1([B-:28]([c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)([c:35]2[cH:36][cH:37][cH:38][cH:39][cH:40]2)[c:41]2[cH:42][cH:43][cH:44][cH:45][cH:46]2)[cH:47][cH:48][cH:49][cH:50][cH:51]1.[c:52]1(-[c:53]2[cH:54][cH:55][cH:56][cH:57][cH:58]2)[cH:59][cH:60][cH:61][cH:62][c:63]1[PH+:64]([C:65]([CH3:66])([CH3:67])[CH3:68])[C:69]([CH3:70])([CH3:71])[CH3:72].[c:82]1([CH3:83])[c:84]([CH3:85])[cH:86][cH:87][cH:88][cH:89]1>>[c:2]1([N:8]([c:9]2[cH:10][cH:11][cH:12][cH:13][cH:14]2)[c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[cH:3][cH:4][cH:5][cH:6][cH:7]1

Participants

10

Reactant 9

HCID 175Acetate2×HCID 923Sodium ionHCID 7237O-XyleneHCID 7961BromobenzeneHCID 8934TetraphenylborateHCID 11487DiphenylamineHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 45749132-Methylpropan-2-olateHCID 51385377Ditert-butyl-(2-phenylphenyl)phosphanium

Product 1

HCID 11775Triphenylamine

Sources & evidence

ORD record
ord-e8e6babd788f46a89c57b8e95eb24dce
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Linked notes

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