Citric Acid → Hydrochloric Acid

HRID 1226616Notes

Reaction equation

HRID 1226616 reaction equation
[C:53]([O:54][CH2:55][CH3:56])(=[O:57])[CH3:58].[CH2:1]([CH3:2])[O:3][CH2:4][CH2:5][O:6][c:7]1[cH:8][c:9]([CH3:37])[c:10](-[c:14]2[cH:15][c:16]([CH2:20][NH:21][c:22]3[cH:23][c:24]([F:36])[c:25]([CH:28]4[CH:29]([C:31](=[O:32])[O:33][CH2:34][CH3:35])[CH2:30]4)[cH:26][cH:27]3)[cH:17][cH:18][cH:19]2)[c:11]([CH3:13])[cH:12]1.[CH3:60][CH2:61][OH:62].[CH3:68][CH2:69][O:70][C:71](=[O:72])[CH3:73].[ClH:59].[Na+:39].[O:63]1[CH2:64][CH2:65][CH2:66][CH2:67]1.[OH-:38].[OH2:74].[OH:40][C:41]([CH2:42][C:43]([C:44](=[O:45])[OH:46])([CH2:47][C:48](=[O:49])[OH:50])[OH:51])=[O:52]>>[CH2:1]([CH3:2])[O:3][CH2:4][CH2:5][O:6][c:7]1[cH:8][c:9]([CH3:37])[c:10](-[c:14]2[cH:15][c:16]([CH2:20][NH:21][c:22]3[cH:23][c:24]([F:36])[c:25]([CH:28]4[CH:29]([C:31](=[O:32])[OH:33])[CH2:30]4)[cH:26][cH:27]3)[cH:17][cH:18][cH:19]2)[c:11]([CH3:13])[cH:12]1.[ClH:59]

Participants

11

Reactant 9

HCID 311Citric AcidHCID 313Hydrochloric AcidHCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 8028TetrahydrofuranHCID 8857Ethyl Acetate2×HCID 66908116HCID 66908116, compound

Product 2

HCID 313Hydrochloric AcidHCID 59364061HCID 59364061, compound

Sources & evidence

ORD record
ord-5efcce7a74244bb1ad8b600090d92b7d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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