Acetone → HCID 59208499, compound

HRID 1145200Notes

Reaction equation

HRID 1145200 reaction equation
[CH3:24][C:25](=[O:26])[CH3:27].[CH:20]([CH3:21])([CH3:22])[OH:23].[Cl-:29].[Cl:6][c:7]1[s:8][c:9]([C:14](=[O:15])[O:16][CH:17]([CH3:18])[CH3:19])[c:10]([CH2:12][OH:13])[n:11]1.[Na+:30].[OH2:28].[S:1](=[O:2])(=[O:3])([OH:4])[OH:5]>>[Cl:6][c:7]1[s:8][c:9]([C:14](=[O:15])[O:16][CH:17]([CH3:18])[CH3:19])[c:10]([C:12](=[O:13])[OH:23])[n:11]1

Participants

8

Reactant 7

HCID 180AcetoneHCID 312ChlorideHCID 923Sodium ionHCID 962WaterHCID 1118Sulfuric AcidHCID 3776IsopropanolHCID 59208454HCID 59208454, compound

Product 1

HCID 59208499HCID 59208499, compound

Sources & evidence

ORD record
ord-a4fe89e282e6450793e4635523964b4a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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