Hydrochloric Acid → HCID 178496259, compound

HRID 1562008Notes

Reaction equation

HRID 1562008 reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([CH:5]([CH2:6][CH:7]([CH2:8][c:9]1[cH:10][cH:11][c:12](-[c:15]2[cH:16][c:17]([F:21])[cH:18][cH:19][cH:20]2)[cH:13][cH:14]1)[NH:22][C:23](=[O:24])[c:25]1[nH:26][n:27][c:28]([Cl:30])[n:29]1)[CH2:31][OH:32])=[O:33].[CH3:34][CH2:35][OH:36].[CH3:40][O:41][CH2:42][CH2:43][O:44][CH2:45][CH2:46][OH:47].[ClH:48].[Li+:38].[O:49]1[CH2:50][CH2:51][O:52][CH2:53][CH2:54]1.[OH-:37].[OH2:39]>>[CH2:1]([CH2:2][O:44][CH2:43][CH2:42][O:41][CH3:40])[O:3][C:4]([CH:5]([CH2:6][CH:7]([CH2:8][c:9]1[cH:10][cH:11][c:12](-[c:15]2[cH:16][c:17]([F:21])[cH:18][cH:19][cH:20]2)[cH:13][cH:14]1)[NH:22][C:23](=[O:24])[c:25]1[nH:26][n:27][c:28]([Cl:30])[n:29]1)[CH2:31][OH:32])=[O:33]

Participants

9

Reactant 8

HCID 313Hydrochloric AcidHCID 702EthanolHCID 961HydroxideHCID 962WaterHCID 8134Diethylene Glycol Monomethyl EtherHCID 28486Lithium ionHCID 312751,4-DioxaneHCID 178472201HCID 178472201, compound

Product 1

HCID 178496259HCID 178496259, compound

Sources & evidence

ORD record
ord-8a6b4e64e08d4c5c8957b2a32d9ab9d7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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