Hydrochloric Acid → HCID 21105735, compound

HRID 2319842Notes

Reaction equation

HRID 2319842 reaction equation
[C:52]([OH:53])([CH3:54])([CH3:55])[CH3:56].[CH3:30][C:31](=[CH:32][CH3:33])[CH3:34].[Cl+:35]([O-:36])[O-:37].[ClH:45].[F:1][C:2]([c:3]1[cH:4][cH:5][c:6](-[c:9]2[n:10][n:11][c:12](-[c:14]3[cH:15][c:16]([CH:17]=[O:18])[cH:19][cH:20][cH:21]3)[o:13]2)[cH:7][cH:8]1)([F:22])[F:23].[Na+:29].[Na+:38].[Na+:43].[Na+:44].[O:47]1[CH2:48][CH2:49][CH2:50][CH2:51]1.[OH2:46].[P:24](=[O:25])([O-:26])([OH:27])[OH:28].[S:39]([O-:40])([O-:41])=[O:42]>>[F:1][C:2]([c:3]1[cH:4][cH:5][c:6](-[c:9]2[n:10][n:11][c:12](-[c:14]3[cH:15][c:16]([C:17](=[O:18])[OH:25])[cH:19][cH:20][cH:21]3)[o:13]2)[cH:7][cH:8]1)([F:22])[F:23]

Participants

11

Reactant 10

HCID 313Hydrochloric AcidHCID 923Sodium ion4×HCID 962WaterHCID 1003DihydrogenphosphateHCID 1099SulfiteHCID 6386tert-ButanolHCID 8028TetrahydrofuranHCID 105532-Methyl-2-buteneHCID 197148ChloriteHCID 21105734HCID 21105734, compound

Product 1

HCID 21105735HCID 21105735, compound

Sources & evidence

ORD record
ord-59a7b56bcc8145c6a8e226691d480d38
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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