Acetone → HCID 54550111, compound

HRID 665355Notes

Reaction equation

HRID 665355 reaction equation
[CH3:28][C:29](=[O:30])[CH3:31].[CH:24]([OH:25])([CH3:26])[CH3:27].[OH:1][CH:2]([CH2:3][c:4]1[cH:5][cH:6][c:7]([CH:8]=[C:9]([C:10](=[O:11])[O:12][CH2:13][CH3:14])[CH3:15])[cH:16][cH:17]1)[c:18]1[cH:19][n:20][cH:21][cH:22][cH:23]1>>[O:1]=[C:2]([CH2:3][c:4]1[cH:5][cH:6][c:7]([CH:8]=[C:9]([C:10](=[O:11])[O:12][CH2:13][CH3:14])[CH3:15])[cH:16][cH:17]1)[c:18]1[cH:19][n:20][cH:21][cH:22][cH:23]1

Participants

4

Reactant 3

HCID 180AcetoneHCID 3776IsopropanolHCID 53632560HCID 53632560, compound

Product 1

HCID 54550111HCID 54550111, compound

Sources & evidence

ORD record
ord-21eaef6d2a1b493a962b1c32581ecd1b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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