Hydrochloric Acid → Hydrochloric Acid

HRID 2132612Notes

Reaction equation

HRID 2132612 reaction equation
[CH2:1]([CH:2]([CH3:3])[CH3:4])[c:5]1[cH:6][cH:7][c:8](-[c:11]2[n:12][n:13][c:14](-[c:16]3[cH:17][cH:18][c:19]([CH2:20][NH:21][CH:22]4[CH2:23][CH:24]([C:26](=[O:27])[O:28][CH2:29][CH3:30])[CH2:25]4)[cH:31][cH:32]3)[o:15]2)[cH:9][cH:10]1.[CH3:36][OH:37].[ClH:35].[Na+:34].[OH-:33]>>[CH2:1]([CH:2]([CH3:3])[CH3:4])[c:5]1[cH:6][cH:7][c:8](-[c:11]2[n:12][n:13][c:14](-[c:16]3[cH:17][cH:18][c:19]([CH2:20][NH:21][CH:22]4[CH2:23][CH:24]([C:26](=[O:27])[OH:28])[CH2:25]4)[cH:31][cH:32]3)[o:15]2)[cH:9][cH:10]1.[ClH:35]

Participants

7

Reactant 5

HCID 313Hydrochloric AcidHCID 887MethanolHCID 923Sodium ionHCID 961HydroxideHCID 59204297Ethyl cis-3-({4-[5-(4-isobutylphenyl)-1,3,4-oxadiazol-2-yl]benzyl}amino)cyclobutanecarboxylate

Product 2

HCID 313Hydrochloric AcidHCID 248954783-[[4-[5-[4-(2-Methylpropyl)phenyl]-1,3,4-oxadiazol-2-yl]phenyl]methylamino]cyclobutane-1-carboxylic acid

Sources & evidence

ORD record
ord-3c86e1798e754698b5c0efd8e8ac29e6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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