Toluene → 1-benzyl-4-chloromethyl-5-phenyl-1H-pyrazole

HRID 1139564Notes

Reaction equation

HRID 1139564 reaction equation
[CH2:5]([c:6]1[cH:7][cH:8][cH:9][cH:10][cH:11]1)[n:12]1[n:13][cH:14][c:15]([CH2:23][OH:24])[c:16]1-[c:17]1[cH:18][cH:19][cH:20][cH:21][cH:22]1.[CH3:25][c:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1.[S:1]([Cl:2])([Cl:3])=[O:4]>>[Cl:3][CH2:23][c:15]1[cH:14][n:13][n:12]([CH2:5][c:6]2[cH:7][cH:8][cH:9][cH:10][cH:11]2)[c:16]1-[c:17]1[cH:18][cH:19][cH:20][cH:21][cH:22]1

Participants

4

Reactant 3

HCID 1140TolueneHCID 24386Thionyl ChlorideHCID 23025093(1-benzyl-5-phenyl-1H-pyrazol-4-yl)methanol

Product 1

HCID 230250441-benzyl-4-chloromethyl-5-phenyl-1H-pyrazole

Sources & evidence

ORD record
ord-69bff70b82dd454e838492b89ecba105
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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