Acetic Acid → HCID 178427280, compound

HRID 109833Notes

Reaction equation

HRID 109833 reaction equation
[BrH:28].[C:1]([CH3:2])([CH3:3])([CH3:4])[n:5]1[n:6][c:7]([C:20]([F:21])([F:22])[F:23])[c:8]([CH2:11][S:12][C:13]2=[N:14][O:15][C:16]([CH3:18])([CH3:19])[CH2:17]2)[c:9]1[Cl:10].[C:24]([OH:25])(=[O:26])[CH3:27].[OH2:29]>>[nH:5]1[n:6][c:7]([C:20]([F:21])([F:22])[F:23])[c:8]([CH2:11][S:12][C:13]2=[N:14][O:15][C:16]([CH3:18])([CH3:19])[CH2:17]2)[c:9]1[Cl:10]

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 260Hydrogen BromideHCID 962WaterHCID 178628593-(1-tert-butyl-5-chloro-3-trifluoromethyl-1H-pyrazol-4-ylmethylthio)-5,5-dimethyl-2-isoxazoline

Product 1

HCID 178427280HCID 178427280, compound

Sources & evidence

ORD record
ord-e0109bfae4764ce4931acdb46a635230
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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