Acetic Acid → HCID 18923584, compound

HRID 685215Notes

Reaction equation

HRID 685215 reaction equation
[CH3:28][C:29](=[O:30])[OH:31].[NH2:1][CH2:2][C:3](=[O:4])[N:5]([CH3:6])[c:7]1[c:8]([Cl:27])[c:9]([CH2:10][O:11][c:12]2[c:13]3[n:14]([cH:15][cH:16][cH:17]2)[c:18]([Br:22])[c:19]([CH3:21])[n:20]3)[c:23]([Cl:26])[cH:24][cH:25]1.[Na:32][O:33][C:34]#[N:35].[OH2:36]>>[NH:1]([CH2:2][C:3](=[O:4])[N:5]([CH3:6])[c:7]1[c:8]([Cl:27])[c:9]([CH2:10][O:11][c:12]2[c:13]3[n:14]([cH:15][cH:16][cH:17]2)[c:18]([Br:22])[c:19]([CH3:21])[n:20]3)[c:23]([Cl:26])[cH:24][cH:25]1)[C:34](=[O:33])[NH2:35]

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 962WaterHCID 10790603HCID 10790603, compoundHCID 178418852HCID 178418852, compound

Product 1

HCID 18923584HCID 18923584, compound

Sources & evidence

ORD record
ord-d3bc921bf83d46829d68b2295f00eb3e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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