Acetone → HCID 12806953, compound

HRID 1145862Notes

Reaction equation

HRID 1145862 reaction equation
[C:33](=[O:34])([OH:35])[O-:36].[CH3:40][C:41](=[O:42])[CH3:43].[Cl-:39].[Cl:1][c:2]1[c:3]2[c:11]([cH:12][c:13]([O:16][CH2:17][C:18](=[O:19])[O:20][CH2:21][CH:22]3[O:23][C:24]([CH3:27])([CH3:28])[O:25][CH2:26]3)[c:14]1[Cl:15])[CH2:10][C:9]1([CH2:29][CH3:30])[C:4]2=[CH:5][C:6](=[O:31])[CH2:7][CH2:8]1.[ClH:32].[Na+:37].[Na+:38]>>[Cl:1][c:2]1[c:3]2[c:11]([cH:12][c:13]([O:16][CH2:17][C:18](=[O:19])[O:20][CH2:21][CH:22]([OH:23])[CH2:26][OH:25])[c:14]1[Cl:15])[CH2:10][C:9]1([CH2:29][CH3:30])[C:4]2=[CH:5][C:6](=[O:31])[CH2:7][CH2:8]1

Participants

7

Reactant 6

HCID 180AcetoneHCID 312ChlorideHCID 313Hydrochloric AcidHCID 769Bicarbonate IonHCID 923Sodium ion2×HCID 12806952HCID 12806952, compound

Product 1

HCID 12806953HCID 12806953, compound

Sources & evidence

ORD record
ord-6d1359a1362945d69ab3d00783bd12c7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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