Acetic Acid → HCID 58042458, compound

HRID 668588Notes

Reaction equation

HRID 668588 reaction equation
[C:1]([O:2][OH:4])(=[O:3])[CH3:5].[CH3:34][C:35](=[O:36])[OH:37].[Cl:6][c:7]1[c:8]([O:22][CH:23]2[CH2:24][CH2:25][CH2:26]2)[n:9][cH:10][c:11]([B:13]2[O:14][C:15]([CH3:16])([CH3:17])[C:18]([CH3:19])([CH3:20])[O:21]2)[cH:12]1.[Na+:32].[Na+:33].[OH2:38].[S:27]([O-:28])([O-:29])(=[O:30])=[S:31]>>[OH:3][c:11]1[cH:10][n:9][c:8]([O:22][CH:23]2[CH2:24][CH2:25][CH2:26]2)[c:7]([Cl:6])[cH:12]1

Participants

7

Reactant 6

HCID 176Acetic AcidHCID 923Sodium ion2×HCID 962WaterHCID 1084Thiosulfate ionHCID 6585Peracetic AcidHCID 58042444HCID 58042444, compound

Product 1

HCID 58042458HCID 58042458, compound

Sources & evidence

ORD record
ord-41326a4e88ed4a119b1c249015534e14
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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