Acetone → HCID 59226538, compound

HRID 1568037Notes

Reaction equation

HRID 1568037 reaction equation
[CH3:33][CH2:34][O:35][C:36](=[O:37])[CH3:38].[CH3:39][C:40](=[O:41])[CH3:42].[F:1][c:2]1[cH:3][cH:4][c:5]([C:18](=[O:19])[O:20][CH3:21])[n:6][c:7]1[CH:8]1[CH2:9][CH2:10][C:11]2([O:12][CH2:15][CH2:14][O:13]2)[CH2:16][CH2:17]1.[Na+:32].[O-:28][C:29]([OH:30])=[O:31].[OH2:43].[OH:22][C:23]([C:24](=[O:25])[OH:26])=[O:27]>>[F:1][c:2]1[cH:3][cH:4][c:5]([C:18](=[O:19])[O:20][CH3:21])[n:6][c:7]1[CH:8]1[CH2:9][CH2:10][C:11](=[O:12])[CH2:16][CH2:17]1

Participants

8

Reactant 7

HCID 180AcetoneHCID 769Bicarbonate IonHCID 923Sodium ionHCID 962WaterHCID 971Oxalic AcidHCID 8857Ethyl AcetateHCID 59226427HCID 59226427, compound

Product 1

HCID 59226538HCID 59226538, compound

Sources & evidence

ORD record
ord-5bd9875df7b44dbeba9bfa284b6b3181
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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