Acetate → HCID 86602402, compound

HRID 2148965Notes

Reaction equation

HRID 2148965 reaction equation
[CH2:41]([O:42][CH2:43][CH3:44])[CH3:45].[CH3:34][C:35](=[O:36])[O-:37].[Cl:1][c:2]1[n:3][cH:4][cH:5][c:6](-[c:8]2[c:9]3[c:10]([n:11][c:12]([CH3:16])[c:13]2[CH2:14][OH:15])[n:17]([CH2:20][CH3:21])[n:18][cH:19]3)[cH:7]1.[Cl:38][CH2:39][Cl:40].[Na+:33].[O:22]=[Cr:23]([Cl:24])([O-:25])=[O:26].[nH+:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1>>[Cl:1][c:2]1[n:3][cH:4][cH:5][c:6](-[c:8]2[c:9]3[c:10]([n:11][c:12]([CH3:16])[c:13]2[CH:14]=[O:15])[n:17]([CH2:20][CH3:21])[n:18][cH:19]3)[cH:7]1

Participants

8

Reactant 7

HCID 175AcetateHCID 923Sodium ionHCID 3283Diethyl EtherHCID 6344DichloromethaneHCID 4989215PyridiniumHCID 86602403HCID 86602403, compoundHCID 178418299HCID 178418299, compound

Product 1

HCID 86602402HCID 86602402, compound

Sources & evidence

ORD record
ord-1fda410ce6a149a09d73c571a2d54fef
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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