4-Ethylphenyl isocyanate → HCID 178436618, compound

HRID 1141838Notes

Reaction equation

HRID 1141838 reaction equation
[CH2:20]([CH3:21])[c:22]1[cH:23][cH:24][c:25]([N:28]=[C:29]=[O:30])[cH:26][cH:27]1.[nH:1]1[n:2][n:3][n:4][c:5]1-[c:6]1[n:7][cH:8][cH:9][c:10]([O:12][c:13]2[cH:14][cH:15][c:16]([NH2:19])[cH:17][cH:18]2)[cH:11]1>>[nH:1]1[n:2][n:3][n:4][c:5]1-[c:6]1[n:7][cH:8][cH:9][c:10]([O:12][c:13]2[cH:14][cH:15][c:16]([NH:19][C:29]([NH:28][c:25]3[cH:24][cH:23][c:22]([CH2:20][CH3:21])[cH:27][cH:26]3)=[O:30])[cH:17][cH:18]2)[cH:11]1

Participants

3

Reactant 2

HCID 900074-Ethylphenyl isocyanateHCID 178507761HCID 178507761, compound

Product 1

HCID 178436618HCID 178436618, compound

Sources & evidence

ORD record
ord-4ad38d73f9ca42cdb39a95fa279dd611
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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