Dichloromethane → 3-tert-Butyl-5-isocyanato-1-p-tolyl-1H-pyrazole

HRID 297743Notes

Reaction equation

HRID 297743 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[n:6][n:7](-[c:11]2[cH:12][cH:13][c:14]([CH3:17])[cH:15][cH:16]2)[c:8]([NH2:10])[cH:9]1.[CH3:26][CH2:27][CH2:28][CH:29]([CH3:30])[CH3:31].[Cl:32][CH2:33][Cl:34].[O:18]=[C:19]([Cl:20])[O:21][C:22]([Cl:23])([Cl:24])[Cl:25]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[n:6][n:7](-[c:11]2[cH:12][cH:13][c:14]([CH3:17])[cH:15][cH:16]2)[c:8]([N:10]=[C:19]=[O:18])[cH:9]1

Participants

5

Reactant 4

HCID 6344DichloromethaneHCID 78922-MethylpentaneHCID 10426DiphosgeneHCID 29741323-tert-butyl-1-(4-methylphenyl)-1H-pyrazol-5-amine

Product 1

HCID 179878553-tert-Butyl-5-isocyanato-1-p-tolyl-1H-pyrazole

Sources & evidence

ORD record
ord-66cb7218badd42ff9a3867b660b0f613
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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