Acetic Acid → HCID 21108671, compound

HRID 116760Notes

Reaction equation

HRID 116760 reaction equation
[CH2:1]([O:3][CH:4]([O:2][CH2:32][CH3:33])[c:5]1[cH:6][c:7](-[c:10]2[cH:11][cH:12][c:13](-[c:16]3[o:17][c:18]([CH2:21][S:22][CH2:23][CH2:24][O:25][c:26]4[cH:27][cH:28][cH:29][cH:30][cH:31]4)[n:19][n:20]3)[cH:14][cH:15]2)[n:8][o:9]1)[CH3:34].[CH3:36][C:37](=[O:38])[OH:39].[ClH:35].[OH2:40]>>[O:3]=[CH:4][c:5]1[cH:6][c:7](-[c:10]2[cH:11][cH:12][c:13](-[c:16]3[o:17][c:18]([CH2:21][S:22][CH2:23][CH2:24][O:25][c:26]4[cH:27][cH:28][cH:29][cH:30][cH:31]4)[n:19][n:20]3)[cH:14][cH:15]2)[n:8][o:9]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 313Hydrochloric AcidHCID 962WaterHCID 21108608HCID 21108608, compound

Product 1

HCID 21108671HCID 21108671, compound

Sources & evidence

ORD record
ord-caae13b46c8a426090a64aacf3674990
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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