Acetone → HCID 21350774, compound

HRID 1230430Notes

Reaction equation

HRID 1230430 reaction equation
[CH3:27][C:28]([CH3:29])=[O:30].[ClH:26].[OH:1][CH2:2][CH:3]1[NH:4][N:5]=[C:6]([c:17]2[cH:18][cH:19][c:20]([N+:23](=[O:24])[O-:25])[cH:21][cH:22]2)[c:7]2[c:8]([cH:10][c:11]3[c:12]([cH:13]2)[O:14][CH2:15][O:16]3)[CH2:9]1>>[O:1]1[CH2:2][CH:3]2[N:4]([N:5]=[C:6]([c:17]3[cH:18][cH:19][c:20]([N+:23](=[O:24])[O-:25])[cH:21][cH:22]3)[c:7]3[c:8]([cH:10][c:11]4[c:12]([cH:13]3)[O:14][CH2:15][O:16]4)[CH2:9]2)[C:28]1([CH3:27])[CH3:29]

Participants

4

Reactant 3

HCID 180AcetoneHCID 313Hydrochloric AcidHCID 18183107HCID 18183107, compound

Product 1

HCID 21350774HCID 21350774, compound

Sources & evidence

ORD record
ord-33b3919c2ee04baaa8e29c763a8e4ad8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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