Acetic Acid → Hydrochloric Acid

HRID 2340092Notes

Reaction equation

HRID 2340092 reaction equation
[C:45]([OH:46])(=[O:47])[CH3:48].[CH3:58][OH:59].[CH3:60][CH2:61][O:62][CH2:63][CH3:64].[ClH:1].[NH2:49][C:50]([CH2:51][OH:52])([CH2:53][OH:54])[CH:55]([CH3:56])[CH3:57].[c:27]1([CH:28]=[O:29])[c:30]2[c:31]3[c:32]4[c:33]([cH:34][cH:35]2)[cH:36][cH:37][cH:38][c:39]4[cH:40][cH:41][c:42]3[cH:43][cH:44]1.[c:2]1([CH2:18][NH:19][C:20]([CH3:21])([CH:22]([OH:23])[CH3:24])[CH2:25][OH:26])[cH:3][cH:4][c:5]2[cH:6][cH:7][c:8]3[cH:9][cH:10][cH:11][c:12]4[cH:13][cH:14][c:15]1[c:16]2[c:17]34>>[ClH:1].[c:2]1([CH2:18][NH:49][C:50]([CH2:51][OH:52])([CH2:53][OH:54])[CH:55]([CH3:56])[CH3:57])[cH:3][cH:4][c:5]2[cH:6][cH:7][c:8]3[cH:9][cH:10][cH:11][c:12]4[cH:13][cH:14][c:15]1[c:16]2[c:17]34

Participants

9

Reactant 7

HCID 176Acetic AcidHCID 313Hydrochloric AcidHCID 887MethanolHCID 3283Diethyl EtherHCID 2328481-PyrenecarboxaldehydeHCID 123392712-Amino-2-isopropylpropane-1,3-diolHCID 147630102-Methyl-2-(pyren-1-ylmethylamino)butane-1,3-diol

Product 2

HCID 313Hydrochloric AcidHCID 147630082-Propan-2-yl-2-(pyren-1-ylmethylamino)propane-1,3-diol

Sources & evidence

ORD record
ord-68033753cbe1431cb5cd469d9e9d8580
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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