Acetic Acid → HCID 59164563, compound

HRID 1538744Notes

Reaction equation

HRID 1538744 reaction equation
[C:42]([OH:43])(=[O:44])[CH3:45].[F:1][c:2]1[c:3]([C:9]2([S:19](=[O:20])(=[O:21])[N:22]3[CH2:23][CH2:24][CH:25]([F:28])[CH2:26][CH2:27]3)[CH2:10][CH2:11][C:12]3([O:13][CH2:16][CH2:15][O:14]3)[CH2:17][CH2:18]2)[cH:4][c:5]([F:8])[cH:6][cH:7]1.[OH2:40].[OH2:41].[c:29]1([CH3:30])[cH:31][cH:32][c:33]([S:34]([OH:35])(=[O:36])=[O:37])[cH:38][cH:39]1>>[F:1][c:2]1[c:3]([C:9]2([S:19](=[O:20])(=[O:21])[N:22]3[CH2:23][CH2:24][CH:25]([F:28])[CH2:26][CH2:27]3)[CH2:10][CH2:11][C:12](=[O:13])[CH2:17][CH2:18]2)[cH:4][c:5]([F:8])[cH:6][cH:7]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 962Water2×HCID 6101p-Toluenesulfonic acidHCID 59164565HCID 59164565, compound

Product 1

HCID 59164563HCID 59164563, compound

Sources & evidence

ORD record
ord-a81916114b804f0e9076bbf4d1ae4137
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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