Acetic Acid → HCID 11644909, compound

HRID 208093Notes

Reaction equation

HRID 208093 reaction equation
[C:1]([CH3:2])(=[O:3])[c:4]1[cH:5][cH:6][c:7]([S:10][c:11]2[cH:12][cH:13][c:14]([C:17]([CH3:18])=[O:19])[cH:15][cH:16]2)[cH:8][cH:9]1.[CH3:20][C:21]([OH:22])=[O:23].[Cl-:30].[Cl-:31].[Cl-:32].[Cl:24][CH:25]([Cl:26])[CH3:27].[OH2:34].[OH:28][OH:29].[Ti+3:33]>>[C:1]([CH3:2])(=[O:3])[c:4]1[cH:5][cH:6][c:7]([S:10]([c:11]2[cH:12][cH:13][c:14]([C:17]([CH3:18])=[O:19])[cH:15][cH:16]2)=[O:22])[cH:8][cH:9]1

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 312Chloride3×HCID 784Hydrogen PeroxideHCID 962WaterHCID 63651,1-DichloroethaneHCID 520243bis(4-acetylphenyl)sulfideHCID 5153393TiIII

Product 1

HCID 11644909HCID 11644909, compound

Sources & evidence

ORD record
ord-0ad2a778dde341f4a86487190a1d1e3e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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