Hydrochloric Acid → HCID 90825165, compound

HRID 1230328Notes

Reaction equation

HRID 1230328 reaction equation
[CH2:45]1[O:46][CH2:47][CH2:48][CH2:49]1.[ClH:44].[F:1][c:2]1[c:3]([CH3:33])[cH:4][c:5]([CH2:6][O:7][CH2:8][CH2:9][CH2:10][CH2:11][CH:12]([C:13](=[O:14])[N:15]2[CH:16]([CH2:17][c:18]3[cH:19][cH:20][cH:21][cH:22][cH:23]3)[CH2:24][O:25][C:26]2=[O:27])[N:28]=[N+:29]=[N-:30])[cH:31][cH:32]1.[Li+:37].[Na+:42].[Na+:43].[OH-:36].[OH2:50].[OH2:51].[OH:34][OH:35].[S:38](=[O:39])([O-:40])[O-:41]>>[F:1][c:2]1[c:3]([CH3:33])[cH:4][c:5]([CH2:6][O:7][CH2:8][CH2:9][CH2:10][CH2:11][CH:12]([C:13]([OH:14])=[O:39])[N:28]=[N+:29]=[N-:30])[cH:31][cH:32]1

Participants

10

Reactant 9

HCID 313Hydrochloric AcidHCID 784Hydrogen PeroxideHCID 923Sodium ion2×HCID 961HydroxideHCID 962Water2×HCID 1099SulfiteHCID 8028TetrahydrofuranHCID 28486Lithium ionHCID 178426853HCID 178426853, compound

Product 1

HCID 90825165HCID 90825165, compound

Sources & evidence

ORD record
ord-756ed9cff45d472a8bfc5beabe49c943
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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