Acetone → HCID 59553098, compound

HRID 1220140Notes

Reaction equation

HRID 1220140 reaction equation
[CH3:38][CH2:39][O:40][C:41](=[O:42])[CH3:43].[CH3:44][C:45](=[O:46])[CH3:47].[CH3:48][S:49]([CH3:50])=[O:51].[Cl:1][CH2:2][CH2:3][O:4][c:5]1[cH:6][cH:7][c:8]([NH:15][C:16]([c:17]2[cH:18][c:19]([F:29])[cH:20][c:21]([N:23]3[CH2:24][CH2:25][CH2:26][CH2:27][CH2:28]3)[cH:22]2)=[O:30])[c:9]2[cH:10][cH:11][cH:12][cH:13][c:14]12.[OH:31][CH:32]1[CH2:33][CH2:34][NH:35][CH2:36][CH2:37]1>>[CH2:2]([CH2:3][O:4][c:5]1[cH:6][cH:7][c:8]([NH:15][C:16]([c:17]2[cH:18][c:19]([F:29])[cH:20][c:21]([N:23]3[CH2:24][CH2:25][CH2:26][CH2:27][CH2:28]3)[cH:22]2)=[O:30])[c:9]2[cH:10][cH:11][cH:12][cH:13][c:14]12)[N:35]1[CH2:34][CH2:33][CH:32]([OH:31])[CH2:37][CH2:36]1

Participants

6

Reactant 5

HCID 180AcetoneHCID 679Dimethyl SulfoxideHCID 8857Ethyl AcetateHCID 79341Piperidin-4-olHCID 59553352HCID 59553352, compound

Product 1

HCID 59553098HCID 59553098, compound

Sources & evidence

ORD record
ord-4ed3ebe919c64e288d643766b9335dc4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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