Hydrochloric Acid → Hydrochloric Acid

HRID 1226791Notes

Reaction equation

HRID 1226791 reaction equation
[C:52](=[O:53])([O-:54])[OH:55].[C:57]([O:58][CH2:59][CH3:60])(=[O:61])[CH3:62].[CH:64]([Cl:65])([Cl:66])[Cl:67].[ClH:63].[Na+:56].[O:1]1[CH2:2][CH2:3][O:4][c:5]2[c:6]1[cH:7][cH:8][c:9]([CH2:11][N:12]([C:13](=[O:14])[O:15][C:16]([CH3:17])([CH3:18])[CH3:19])[CH:20]1[CH2:21][CH2:22][N:23]([CH2:26][CH2:27][n:28]3[c:29](=[O:44])[cH:30][c:31](-[c:38]4[cH:39][cH:40][n:41][cH:42][cH:43]4)[c:32]4[cH:33][cH:34][cH:35][cH:36][c:37]34)[CH2:24][CH2:25]1)[cH:10]2.[OH:45][C:46]([C:47]([F:48])([F:49])[F:50])=[O:51]>>[ClH:63].[O:1]1[CH2:2][CH2:3][O:4][c:5]2[c:6]1[cH:7][cH:8][c:9]([CH2:11][NH:12][CH:20]1[CH2:21][CH2:22][N:23]([CH2:26][CH2:27][n:28]3[c:29](=[O:44])[cH:30][c:31](-[c:38]4[cH:39][cH:40][n:41][cH:42][cH:43]4)[c:32]4[cH:33][cH:34][cH:35][cH:36][c:37]34)[CH2:24][CH2:25]1)[cH:10]2

Participants

9

Reactant 7

HCID 313Hydrochloric AcidHCID 769Bicarbonate IonHCID 923Sodium ionHCID 6212ChloroformHCID 6422Trifluoroacetic acidHCID 8857Ethyl AcetateHCID 59397987HCID 59397987, compound

Product 2

HCID 313Hydrochloric AcidHCID 59397904HCID 59397904, compound

Sources & evidence

ORD record
ord-8d4e54c2cbef4001a52df0f44e533908
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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