Acetic Acid → Hydrochloric Acid

HRID 1543307Notes

Reaction equation

HRID 1543307 reaction equation
[C:38]([BH3-:39])#[N:40].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([O:34][CH3:35])[cH:11][c:12]2[c:17]([cH:18]1)[CH:16]([C:19]1([c:23]3[cH:24][cH:25][c:26]([O:29][C:30]([F:31])([F:32])[F:33])[cH:27][cH:28]3)[CH2:20][CH2:21][CH2:22]1)[NH:15][CH2:14][CH2:13]2.[CH2:36]=[O:37].[CH3:45][C:46](=[O:47])[OH:48].[CH3:49][C:50]#[N:51].[ClH:44].[Na+:41].[Na+:43].[OH-:42]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([O:34][CH3:35])[cH:11][c:12]2[c:17]([cH:18]1)[CH:16]([C:19]1([c:23]3[cH:24][cH:25][c:26]([O:29][C:30]([F:31])([F:32])[F:33])[cH:27][cH:28]3)[CH2:20][CH2:21][CH2:22]1)[N:15]([CH3:38])[CH2:14][CH2:13]2.[ClH:44]

Participants

10

Reactant 8

HCID 176Acetic AcidHCID 313Hydrochloric AcidHCID 712FormaldehydeHCID 923Sodium ion2×HCID 961HydroxideHCID 6342AcetonitrileHCID 498716Cyano-borohydrideHCID 22406723HCID 22406723, compound

Product 2

HCID 313Hydrochloric AcidHCID 22406803HCID 22406803, compound

Sources & evidence

ORD record
ord-fd02bc38f91340db8886b955d1b6eacb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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