4-(Difluoromethoxy)phenyl isocyanate → HCID 57445311, compound

HRID 2318259Notes

Reaction equation

HRID 2318259 reaction equation
[F:20][CH:21]([O:22][c:23]1[cH:24][cH:25][c:26]([N:29]=[C:30]=[O:31])[cH:27][cH:28]1)[F:32].[NH2:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[c:9]([C:17](=[O:18])[NH2:19])[nH:10][c:11]3[n:12][cH:13][cH:14][cH:15][c:16]23)[cH:6][cH:7]1>>[NH:1]([c:2]1[cH:3][cH:4][c:5](-[c:8]2[c:9]([C:17](=[O:18])[NH2:19])[nH:10][c:11]3[n:12][cH:13][cH:14][cH:15][c:16]23)[cH:6][cH:7]1)[C:30]([NH:29][c:26]1[cH:25][cH:24][c:23]([O:22][CH:21]([F:20])[F:32])[cH:28][cH:27]1)=[O:31]

Participants

3

Sources & evidence

ORD record
ord-f8db576b257a40c3bff5b33df7ae2856
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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