Benzene → Phenylurea

HRID 304883

Reaction equation

HRID 304883 reaction equation
[CH3:30][CH2:31][O:32][C:33](=[O:34])[CH3:35].[NH2:1][C:2]1=[C:8]([c:9]2[cH:10][cH:11][cH:12][cH:13][cH:14]2)[CH:6]([CH3:7])[NH:5][N:3]1[CH3:4].[c:15]1([N:21]=[C:22]=[O:23])[cH:16][cH:17][cH:18][cH:19][cH:20]1.[cH:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1>>[NH2:1][C:22]([NH:21][c:15]1[cH:16][cH:17][cH:18][cH:19][cH:20]1)=[O:23]

Participants

5

Reactant 4

HCID 241BenzeneHCID 7672Phenyl isocyanateHCID 8857Ethyl AcetateHCID 233327722,5-Dimethyl-4-phenyl-1,5-dihydropyrazol-3-amine

Product 1

HCID 6145Phenylurea

Sources & evidence

ORD record
ord-2515019c5c3849798517318ab356eb89
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Linked notes

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