Water → Isoxazole, 4-(chloromethyl)-5-methyl-3-phenyl-

HRID 1145418Notes

Reaction equation

[CH3:1][c:2]1[c:3]([CH2:13][OH:14])[c:4](-[c:7]2[cH:8][cH:9][cH:10][cH:11][cH:12]2)[n:5][o:6]1.[Cl:19][CH2:20][Cl:21].[OH2:22].[S:15]([Cl:16])([Cl:17])=[O:18]>>[CH3:1][c:2]1[c:3]([CH2:13][Cl:17])[c:4](-[c:7]2[cH:8][cH:9][cH:10][cH:11][cH:12]2)[n:5][o:6]1

Participants

Reactant 4

HCID 962Water

HCID 6344Dichloromethane

HCID 24386Thionyl Chloride

HCID 2776149(5-Methyl-3-phenyl-1,2-oxazol-4-yl)methanol

Product 1

HCID 11052826Isoxazole, 4-(chloromethyl)-5-methyl-3-phenyl-

Sources & evidence

ORD record: ord-f69c2bafcbb94b9b8f03a947fa2ee0dc
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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