Acetic Acid → HCID 69286939, compound

HRID 1548866Notes

Reaction equation

HRID 1548866 reaction equation
[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[n:7][c:8]([N:11]([c:12]2[cH:13][c:14]([O:20][CH3:21])[c:15]([O:18][CH3:19])[cH:16][cH:17]2)[C:22]([c:23]2[c:24]([Cl:30])[cH:25][c:26]([Cl:29])[cH:27][cH:28]2)=[O:31])[s:9][cH:10]1.[CH3:32][C:33](=[O:34])[OH:35].[ClH:36].[O:37]1[CH2:38][CH2:39][O:40][CH2:41][CH2:42]1>>[O:3]=[C:4]([OH:5])[c:6]1[n:7][c:8]([N:11]([c:12]2[cH:13][c:14]([O:20][CH3:21])[c:15]([O:18][CH3:19])[cH:16][cH:17]2)[C:22]([c:23]2[c:24]([Cl:30])[cH:25][c:26]([Cl:29])[cH:27][cH:28]2)=[O:31])[s:9][cH:10]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 313Hydrochloric AcidHCID 312751,4-DioxaneHCID 11190834HCID 11190834, compound

Product 1

HCID 69286939HCID 69286939, compound

Sources & evidence

ORD record
ord-758ed7c82aa645c48eea61d3a9d37d4b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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