Acetic Acid → HCID 136161628, compound

HRID 1237173Notes

Reaction equation

HRID 1237173 reaction equation
[BrH:23].[CH3:19][C:20](=[O:21])[OH:22].[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6](-[c:9]2[n:10]([CH3:18])[cH:11][c:12]([C:14]([F:15])([F:16])[F:17])[n:13]2)[cH:7][cH:8]1.[OH2:24]>>[OH:2][c:3]1[cH:4][cH:5][c:6](-[c:9]2[n:10]([CH3:18])[cH:11][c:12]([C:14]([F:15])([F:16])[F:17])[n:13]2)[cH:7][cH:8]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 260Hydrogen BromideHCID 962WaterHCID 20255075HCID 20255075, compound

Product 1

HCID 136161628HCID 136161628, compound

Sources & evidence

ORD record
ord-4cb8382446664837a526a4a17ff3df64
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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