Acetone → HCID 68488610, compound

HRID 115121Notes

Reaction equation

HRID 115121 reaction equation
[CH3:22][CH:23]([CH3:24])[OH:25].[CH3:28][C:29](=[O:30])[CH3:31].[CH3:32][CH2:33][O:34][C:35](=[O:36])[CH3:37].[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:20]1)[C:7]([C:12]([F:13])([F:14])[F:15])([CH2:16][CH2:17][CH2:18][OH:19])[O:8][C:9](=[O:11])[NH:10]2.[Na+:27].[OH-:26].[OH2:21]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:20]1)[C:7]([C:12]([F:13])([F:14])[F:15])([CH2:16][CH2:17][C:18](=[O:19])[OH:25])[O:8][C:9](=[O:11])[NH:10]2

Participants

8

Reactant 7

HCID 180AcetoneHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 3776IsopropanolHCID 8857Ethyl AcetateHCID 68490016HCID 68490016, compound

Product 1

HCID 68488610HCID 68488610, compound

Sources & evidence

ORD record
ord-ef7471e5bcd647eeb92c82d2cad71a5d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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