Acetate → Triphenylamine

HRID 2310122Notes

Reaction equation

HRID 2310122 reaction equation
[Br:1][c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1.[CH2:52]([PH+:53]([CH:54]1[CH2:55][CH2:56][CH2:57][CH2:58][CH2:59]1)[CH:60]1[CH2:61][CH2:62][CH2:63][CH2:64][CH2:65]1)[CH2:66][CH2:67][CH3:68].[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-:70][C:71]([CH3:72])=[O:73].[O-:74][C:75]([CH3:76])=[O:77].[Pd+2:69].[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:78]1([CH3:79])[c:80]([CH3:81])[cH:82][cH:83][cH:84][cH:85]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 178454892HCID 178454892, compound

Product 1

HCID 11775Triphenylamine

Sources & evidence

ORD record
ord-515badfed4524aa99ebff78a611d6c1a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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