Acetic Acid → HCID 21028581, compound

HRID 2347232Notes

Reaction equation

HRID 2347232 reaction equation
[CH2:2]([CH2:3][CH2:4][CH3:5])[O:6][C:7](=[O:8])[c:9]1[c:10]([O:22][C:23]([C:24]([CH3:25])([CH3:26])[CH3:27])=[O:28])[c:11]2[c:12]([s:13]1)[cH:14][cH:15][c:16]([O:18][CH2:19][O:20][CH3:21])[cH:17]2.[CH3:30][CH2:31][CH2:32][CH2:33][CH2:34][CH3:35].[CH3:36][C:37](=[O:38])[OH:39].[ClH:1].[OH2:29]>>[CH2:2]([CH2:3][CH2:4][CH3:5])[O:6][C:7](=[O:8])[c:9]1[c:10]([O:22][C:23]([C:24]([CH3:25])([CH3:26])[CH3:27])=[O:28])[c:11]2[c:12]([s:13]1)[cH:14][cH:15][c:16]([OH:18])[cH:17]2

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 313Hydrochloric AcidHCID 962WaterHCID 8058HexaneHCID 21028579HCID 21028579, compound

Product 1

HCID 21028581HCID 21028581, compound

Sources & evidence

ORD record
ord-5dc6a529b84b41e5bfd21311577b58a9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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