Acetone → HCID 22224751, compound

HRID 1203290Notes

Reaction equation

HRID 1203290 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH2:7][C:8](=[O:9])[c:10]1[cH:11][c:12]([C:16]#[N:17])[n:13][cH:14][cH:15]1)=[O:18].[CH3:39][C:40](=[O:41])[CH3:42].[F:19][C:20]([F:21])([F:22])[C:23]([O:24][C:25](=[O:26])[C:27]([F:28])([F:29])[F:30])=[O:31].[F:32][C:33]([F:34])([F:35])[C:36]([OH:37])=[O:38]>>[C:1]1([CH3:2])([CH3:3])[O:5][C:6](=[O:18])[CH:7]=[C:8]([c:10]2[cH:11][c:12]([C:16]#[N:17])[n:13][cH:14][cH:15]2)[O:9]1

Participants

5

Reactant 4

HCID 180AcetoneHCID 6422Trifluoroacetic acidHCID 9845Trifluoroacetic anhydrideHCID 695928163-(2-Cyano-pyridin-4-yl)-3-oxo-propionic acid tert-butyl ester

Product 1

HCID 22224751HCID 22224751, compound

Sources & evidence

ORD record
ord-39a926262cad4a5493c4756cf5545fff
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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