Benzene → Mieshuan

HRID 1145582Notes

Reaction equation

HRID 1145582 reaction equation
[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]([N:10]=[C:11]=[O:12])[cH:8][cH:9]1.[cH:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1.[n:13]1[cH:14][c:15]([CH2:19][OH:20])[cH:16][cH:17][cH:18]1>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]([NH:10][C:11](=[O:12])[O:20][CH2:19][c:15]2[cH:14][n:13][cH:18][cH:17][cH:16]2)[cH:8][cH:9]1

Participants

4

Reactant 3

HCID 241BenzeneHCID 75103-PyridinemethanolHCID 66012Benzene, 1-isocyanato-4-nitro-

Product 1

HCID 40068Mieshuan

Sources & evidence

ORD record
ord-72c27f4bdbc54c9bbc5e12fb8a0ddca9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

Loading…