Acetic Acid → HCID 14539520, compound

HRID 702433Notes

Reaction equation

HRID 702433 reaction equation
[C:17](#[N:18])[CH2:19][C:20](=[O:21])[O:22][CH2:23][CH3:24].[CH3:37][C:38](=[O:39])[OH:40].[F:1][c:2]1[cH:3][cH:4][c:5]([C:6](=[O:7])[c:8]2[cH:9][cH:10][c:11]([F:14])[cH:12][cH:13]2)[cH:15][cH:16]1.[NH2:31][CH2:32][CH2:33][C:34]([OH:35])=[O:36].[cH:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1>>[F:1][c:2]1[cH:3][cH:4][c:5]([C:6]([c:8]2[cH:9][cH:10][c:11]([F:14])[cH:12][cH:13]2)=[C:19]([C:17]#[N:18])[C:20](=[O:21])[O:22][CH2:23][CH3:24])[cH:15][cH:16]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 239Beta-AlanineHCID 241BenzeneHCID 7764Ethyl cyanoacetateHCID 95824,4'-Difluorobenzophenone

Product 1

HCID 14539520HCID 14539520, compound

Sources & evidence

ORD record
ord-56b524ab9a6f4a73a95c0928e44e22ce
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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