2-(Trifluoromethyl)phenyl isocyanate → HCID 21184754, compound

HRID 672888Notes

Reaction equation

HRID 672888 reaction equation
[F:12][C:13]([c:14]1[c:15]([N:20]=[C:21]=[O:22])[cH:16][cH:17][cH:18][cH:19]1)([F:23])[F:24].[OH:1][c:2]1[c:3]([NH2:4])[cH:5][cH:6][c:7]([N+:9](=[O:10])[O-:11])[cH:8]1>>[OH:1][c:2]1[c:3]([NH:4][C:21]([NH:20][c:15]2[c:14]([C:13]([F:12])([F:23])[F:24])[cH:19][cH:18][cH:17][cH:16]2)=[O:22])[cH:5][cH:6][c:7]([N+:9](=[O:10])[O-:11])[cH:8]1

Participants

3

Sources & evidence

ORD record
ord-d14fcdcf7de24e17b2b3a138ee73d923
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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