Acetic Acid → HCID 25061042, compound

HRID 1207423Notes

Reaction equation

HRID 1207423 reaction equation
[Br:33][Br:34].[C:29]([OH:30])(=[O:31])[CH3:32].[CH2:35]1[O:36][CH2:37][CH2:38][O:39][CH2:40]1.[CH3:41][CH2:42][O:43][C:44]([CH3:45])=[O:46].[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[cH:9][c:10]3[c:11]([n:12][c:13]2-[c:14]2[c:15]([Cl:21])[cH:16][c:17]([Cl:20])[cH:18][cH:19]2)[O:22][C:23]([CH3:27])([CH3:28])[CH2:24][C:25]3=[O:26])[cH:6][cH:7]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[cH:9][c:10]3[c:11]([n:12][c:13]2-[c:14]2[c:15]([Cl:21])[cH:16][c:17]([Cl:20])[cH:18][cH:19]2)[O:22][C:23]([CH3:27])([CH3:28])[CH:24]([Br:33])[C:25]3=[O:26])[cH:6][cH:7]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 8857Ethyl AcetateHCID 24408BromineHCID 312751,4-DioxaneHCID 24996234HCID 24996234, compound

Product 1

HCID 25061042HCID 25061042, compound

Sources & evidence

ORD record
ord-ddbd383273a041d0ae8ec64dcf99d10f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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