Acetic Acid → Hydrochloric Acid

HRID 88848Notes

Reaction equation

HRID 88848 reaction equation
[C:30]([BH3-:31])#[N:32].[CH2:19]([O:20][C:22]1([O:21][Si:25]([CH3:26])([CH3:27])[CH3:28])[CH2:23][CH2:24]1)[CH3:29].[CH3:36][OH:37].[CH3:38][C:39](=[O:40])[OH:41].[CH3:42][CH2:43][N:44]([CH2:45][CH3:46])[CH2:47][CH3:48].[ClH:1].[NH:2]1[CH2:3][CH2:4][CH:5]([O:8][c:9]2[cH:10][c:11]3[cH:12][cH:13][n:14][cH:15][c:16]3[cH:17][cH:18]2)[CH2:6][CH2:7]1.[Na+:33].[Na+:35].[OH-:34]>>[ClH:1].[N:2]1([CH:22]2[CH2:23][CH2:24]2)[CH2:3][CH2:4][CH:5]([O:8][c:9]2[cH:10][c:11]3[cH:12][cH:13][n:14][cH:15][c:16]3[cH:17][cH:18]2)[CH2:6][CH2:7]1

Participants

11

Reactant 9

HCID 176Acetic AcidHCID 313Hydrochloric AcidHCID 887MethanolHCID 923Sodium ion2×HCID 961HydroxideHCID 8471TriethylamineHCID 498716Cyano-borohydrideHCID 2734686(1-Ethoxycyclopropoxy)trimethylsilaneHCID 57646870HCID 57646870, compound

Product 2

HCID 313Hydrochloric AcidHCID 57646732HCID 57646732, compound

Sources & evidence

ORD record
ord-bd82fe005094468c9abfc2610578ee85
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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