Acetic Acid → HCID 136055523, compound

HRID 691870Notes

Reaction equation

HRID 691870 reaction equation
[Br:7][c:8]1[n:9][c:10]([NH:19][c:20]2[n:21][nH:22][c:23]([CH3:25])[cH:24]2)[cH:11][c:12]2[cH:13][c:14]([OH:18])[cH:15][cH:16][c:17]12.[CH3:26][C:27](=[O:28])[OH:29].[CH3:3][CH:4]([CH3:5])[OH:6].[H-:2].[Na+:1]>>[CH3:3][CH:4]([CH3:5])[O:6][c:8]1[n:9][c:10]([NH:19][c:20]2[n:21][nH:22][c:23]([CH3:25])[cH:24]2)[cH:11][c:12]2[cH:13][c:14]([OH:18])[cH:15][cH:16][c:17]12

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 923Sodium ionHCID 3776IsopropanolHCID 166653HydrideHCID 136055516HCID 136055516, compound

Product 1

HCID 136055523HCID 136055523, compound

Sources & evidence

ORD record
ord-30d6c373f6ce41d2b5371df20ec826f8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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