Acetone → HCID 178473275, compound

HRID 1141205Notes

Reaction equation

HRID 1141205 reaction equation
[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[N:6]1[CH:7]([CH2:47][CH3:48])[CH2:8][CH:9]([NH:18][c:19]2[n:20][cH:21][c:22]([NH:40][C:41](=[O:42])[O:43][CH2:44][CH2:45][OH:46])[c:23]([CH2:25][c:26]3[cH:27][c:28]([C:36]([F:37])([F:38])[F:39])[cH:29][c:30]([C:32]([F:33])([F:34])[F:35])[cH:31]3)[n:24]2)[c:10]2[n:11][c:12]([O:16][CH3:17])[cH:13][cH:14][c:15]21.[CH3:53][C:54](=[O:55])[CH3:56].[O:49]=[Cr:50](=[O:51])=[O:52].[S:57](=[O:58])(=[O:59])([OH:60])[OH:61]>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[N:6]1[CH:7]([CH2:47][CH3:48])[CH2:8][CH:9]([NH:18][c:19]2[n:20][cH:21][c:22]([NH:40][C:41](=[O:42])[O:43][CH2:44][C:45](=[O:46])[OH:49])[c:23]([CH2:25][c:26]3[cH:27][c:28]([C:36]([F:37])([F:38])[F:39])[cH:29][c:30]([C:32]([F:33])([F:34])[F:35])[cH:31]3)[n:24]2)[c:10]2[n:11][c:12]([O:16][CH3:17])[cH:13][cH:14][c:15]21

Participants

5

Reactant 4

HCID 180AcetoneHCID 1118Sulfuric AcidHCID 14915Chromium TrioxideHCID 178473274HCID 178473274, compound

Product 1

HCID 178473275HCID 178473275, compound

Sources & evidence

ORD record
ord-3a25fda42c62418c8b14651ab062713c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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