Acetic Acid → HCID 86660488, compound

HRID 163567Notes

Reaction equation

HRID 163567 reaction equation
[C:27]([OH:28])(=[O:29])[CH3:30].[CH3:1][O:2][CH2:3][C:4](=[O:5])[NH:6][c:7]1[n:8][cH:9][cH:10][c:11]([O:13][c:14]2[cH:15][c:16]([O:23][CH3:24])[c:17]([N+:20]([O-:21])=[O:22])[cH:18][cH:19]2)[cH:12]1.[CH3:25][OH:26].[Cl:31][CH2:32][Cl:33]>>[CH3:1][O:2][CH2:3][C:4](=[O:5])[NH:6][c:7]1[n:8][cH:9][cH:10][c:11]([O:13][c:14]2[cH:15][c:16]([O:23][CH3:24])[c:17]([NH2:20])[cH:18][cH:19]2)[cH:12]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 887MethanolHCID 6344DichloromethaneHCID 70921728HCID 70921728, compound

Product 1

HCID 86660488HCID 86660488, compound

Sources & evidence

ORD record
ord-f7cc126f78c6400caddbd7e43c72d974
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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