Phenyl isocyanate → HCID 58677581, compound

HRID 1549439Notes

Reaction equation

HRID 1549439 reaction equation
[NH2:1][c:2]1[cH:3][cH:4][c:5]([CH3:26])[c:6]([C:8](=[O:9])[c:10]2[c:11]([Cl:25])[cH:12][c:13]([NH:16][c:17]3[c:18]([F:24])[cH:19][c:20]([F:23])[cH:21][cH:22]3)[cH:14][cH:15]2)[cH:7]1.[O:27]=[C:28]=[N:29][c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1.[O:36]1[CH2:37][CH2:38][O:39][CH2:40][CH2:41]1>>[NH:1]([c:2]1[cH:3][cH:4][c:5]([CH3:26])[c:6]([C:8](=[O:9])[c:10]2[c:11]([Cl:25])[cH:12][c:13]([NH:16][c:17]3[c:18]([F:24])[cH:19][c:20]([F:23])[cH:21][cH:22]3)[cH:14][cH:15]2)[cH:7]1)[C:28](=[O:27])[NH:29][c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1

Participants

4

Reactant 3

HCID 7672Phenyl isocyanateHCID 312751,4-DioxaneHCID 11538012(5-Amino-2-methyl-phenyl)-[2-chloro-4-(2,4-difluoro-phenylamino)-phenyl]-methanone

Product 1

HCID 58677581HCID 58677581, compound

Sources & evidence

ORD record
ord-ab4b3de9c37e4ffdb08a2aa01943953c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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