Phenethyl isocyanate → HCID 59323241, compound
Reaction equation
[CH2:22]([CH2:23][c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1)[N:30]=[C:31]=[O:32].[F:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][CH:7]2[N:8]([CH2:17][CH2:18][NH2:19])[CH2:9][c:10]3[cH:11][cH:12][cH:13][cH:14][c:15]3[CH2:16]2)[cH:20][cH:21]1>>[F:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][CH:7]2[N:8]([CH2:17][CH2:18][NH:19][C:31]([NH:30][CH2:22][CH2:23][c:24]3[cH:25][cH:26][cH:27][cH:28][cH:29]3)=[O:32])[CH2:9][c:10]3[cH:11][cH:12][cH:13][cH:14][c:15]3[CH2:16]2)[cH:20][cH:21]1Participants
3
Sources & evidence
- ORD record
- ord-fefd01f048364f6394495a54100eceaa
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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