2-Fluoro-5-(trifluoromethyl)phenyl isocyanate → HCID 44134089, compound

HRID 1231074Notes

Reaction equation

HRID 1231074 reaction equation
[F:1][c:2]1[c:3]([N:12]=[C:13]=[O:14])[cH:4][c:5]([C:8]([F:9])([F:10])[F:11])[cH:6][cH:7]1.[NH2:15][c:16]1[c:17]([F:35])[cH:18][c:19]([O:20][c:21]2[cH:22][cH:23][n:24][c:25]3[nH:26][c:27](=[O:32])[c:28]([CH3:31])[n:29][c:30]23)[cH:33][cH:34]1>>[F:1][c:2]1[c:3]([NH:12][C:13](=[O:14])[NH:15][c:16]2[c:17]([F:35])[cH:18][c:19]([O:20][c:21]3[cH:22][cH:23][n:24][c:25]4[nH:26][c:27](=[O:32])[c:28]([CH3:31])[n:29][c:30]34)[cH:33][cH:34]2)[cH:4][c:5]([C:8]([F:9])([F:10])[F:11])[cH:6][cH:7]1

Participants

3

Sources & evidence

ORD record
ord-9ee2525b33be4e7e80c85abe5113c15a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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