Benzoic Acid → Diphenylamine

HRID 1144751Notes

Reaction equation

HRID 1144751 reaction equation
[CH3:17][Si:18]([CH3:19])([CH3:20])[NH:21][Si:22]([CH3:23])([CH3:24])[CH3:25].[CH3:36][Si:37]([N-:38][Si:39]([CH3:40])([CH3:41])[CH3:42])([CH3:43])[CH3:44].[CH3:45][N:46]([CH3:47])[CH:48]=[O:49].[CH3:50][C:51]#[N:52].[CH:27]([N-:28][CH:29]([CH3:30])[CH3:31])([CH3:32])[CH3:33].[Li+:34].[Li+:35].[Li:26].[NH2:10][c:11]1[cH:12][cH:13][cH:14][cH:15][cH:16]1.[O:53]1[CH2:54][CH2:55][CH2:56][CH2:57]1.[OH:1][C:2](=[O:3])[c:4]1[cH:5][cH:6][cH:7][cH:8][cH:9]1>>[c:4]1([NH:10][c:11]2[cH:12][cH:13][cH:14][cH:15][cH:16]2)[cH:5][cH:6][cH:7][cH:8][cH:9]1

Participants

11

Reactant 10

HCID 243Benzoic AcidHCID 6115AnilineHCID 6228DimethylformamideHCID 6342AcetonitrileHCID 8028TetrahydrofuranHCID 13838HexamethyldisilazaneHCID 28486Lithium ion2×HCID 3028194LithiumHCID 3280088Npc316347HCID 5062348Diisopropylamide

Product 1

HCID 11487Diphenylamine

Sources & evidence

ORD record
ord-83f1a5a340b5403da7c39077f353ed55
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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