Acetic Acid → HCID 12433875, compound

HRID 2319127Notes

Reaction equation

HRID 2319127 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8]([C:11]([OH:12])([c:13]2[n:14]([CH2:18][O:19][CH3:20])[cH:15][cH:16][n:17]2)[c:21]2[cH:22][cH:23][c:24]([Cl:27])[cH:25][cH:26]2)[cH:9][cH:10]1.[CH3:28][C:29](=[O:30])[OH:31].[CH3:34][CH2:35][O:36][CH2:37][CH3:38].[CH3:43][OH:44].[CH3:45][CH2:46][OH:47].[CH:39]([OH:40])([CH3:41])[CH3:42].[ClH:32].[OH2:33]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8]([C:11]([OH:12])([c:13]2[n:14][cH:15][cH:16][nH:17]2)[c:21]2[cH:22][cH:23][c:24]([Cl:27])[cH:25][cH:26]2)[cH:9][cH:10]1

Participants

9

Reactant 8

HCID 176Acetic AcidHCID 313Hydrochloric AcidHCID 702EthanolHCID 887MethanolHCID 962WaterHCID 3283Diethyl EtherHCID 3776IsopropanolHCID 4450498HCID 4450498, compound

Product 1

HCID 12433875HCID 12433875, compound

Sources & evidence

ORD record
ord-d1435bad76f540bea6583721f0a6e254
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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