4-Chlorophenyl Isocyanate → HCID 67929414, compound

HRID 1145651Notes

Reaction equation

HRID 1145651 reaction equation
[Cl:21][c:22]1[cH:23][cH:24][c:25]([N:28]=[C:29]=[O:30])[cH:26][cH:27]1.[cH:1]1[cH:2][cH:3][cH:4][c:5]2[c:11]1-[c:10]1[c:9]([cH:15][cH:14][cH:13][cH:12]1)[CH2:8][N:7]([C:16]([O:17][CH2:18][CH3:19])=[NH:20])[CH2:6]2>>[cH:1]1[cH:2][cH:3][cH:4][c:5]2[c:11]1-[c:10]1[c:9]([cH:15][cH:14][cH:13][cH:12]1)[CH2:8][N:7]([C:16]([O:17][CH2:18][CH3:19])=[N:20][C:29]([NH:28][c:25]1[cH:24][cH:23][c:22]([Cl:21])[cH:27][cH:26]1)=[O:30])[CH2:6]2

Participants

3

Reactant 2

HCID 76934-Chlorophenyl IsocyanateHCID 19833914ethyl 5,7-dihydro-6H-dibenz[c,e]azepine-6carboximidate

Product 1

HCID 67929414HCID 67929414, compound

Sources & evidence

ORD record
ord-38c8cbb6f27d430c909c0c270050c15b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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