Hydrochloric Acid → HCID 69214099, compound

HRID 319422Notes

Reaction equation

HRID 319422 reaction equation
[CH3:56][CH2:57][OH:58].[ClH:54].[Na+:53].[O:47]1[CH2:48][CH2:49][CH2:50][CH2:51]1.[OH-:52].[OH2:55].[o:1]1[c:2](-[c:6]2[o:7][c:8]([CH3:46])[c:9]([CH2:11][O:12][c:13]3[c:14]([O:44][CH3:45])[cH:15][c:16]([CH2:17][O:18][c:19]4[n:20][n:21](-[c:36]5[cH:37][cH:38][cH:39][cH:40][cH:41]5)[cH:22][c:23]4[CH:24]=[CH:25][c:26]4[s:27][cH:28][c:29]([C:31](=[O:32])[O:33][CH2:34][CH3:35])[n:30]4)[cH:42][cH:43]3)[n:10]2)[cH:3][cH:4][cH:5]1>>[o:1]1[c:2](-[c:6]2[o:7][c:8]([CH3:46])[c:9]([CH2:11][O:12][c:13]3[c:14]([O:44][CH3:45])[cH:15][c:16]([CH2:17][O:18][c:19]4[n:20][n:21](-[c:36]5[cH:37][cH:38][cH:39][cH:40][cH:41]5)[cH:22][c:23]4[CH:24]=[CH:25][c:26]4[s:27][cH:28][c:29]([C:31](=[O:32])[OH:33])[n:30]4)[cH:42][cH:43]3)[n:10]2)[cH:3][cH:4][cH:5]1

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 8028TetrahydrofuranHCID 69216224HCID 69216224, compound

Product 1

HCID 69214099HCID 69214099, compound

Sources & evidence

ORD record
ord-fb9e1ab0179a43ea809b78a79d787bdc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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