Acetone → HCID 178435321, compound

HRID 692486Notes

Reaction equation

HRID 692486 reaction equation
[CH2:11]([CH3:12])[CH:13]1[CH:14]([O:32][C:33]([CH2:34][Br:35])=[O:36])[C:15]2([CH3:16])[CH:17]([CH2:18]1)[CH:19]1[CH2:20][CH2:21][C:22]3=[CH:23][C:24](=[O:31])[CH2:25][CH2:26][CH:27]3[CH:28]1[CH2:29][CH2:30]2.[CH3:37][C:38](=[O:39])[CH3:40].[OH2:10].[OH:1][C:2](=[O:3])[c:4]1[cH:5][cH:6][cH:7][cH:8][cH:9]1>>[O:1]=[C:2]([O:3][CH2:34][C:33]([O:32][CH:14]1[CH:13]([CH2:11][CH3:12])[CH2:18][CH:17]2[C:15]1([CH3:16])[CH2:30][CH2:29][CH:28]1[CH:19]2[CH2:20][CH2:21][C:22]2=[CH:23][C:24](=[O:31])[CH2:25][CH2:26][CH:27]21)=[O:36])[c:4]1[cH:5][cH:6][cH:7][cH:8][cH:9]1

Participants

5

Reactant 4

HCID 180AcetoneHCID 243Benzoic AcidHCID 962WaterHCID 178435315HCID 178435315, compound

Product 1

HCID 178435321HCID 178435321, compound

Sources & evidence

ORD record
ord-ede4975749e449b1a6f4db94a827da33
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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