Acetic Acid → HCID 21103779, compound

HRID 180622Notes

Reaction equation

HRID 180622 reaction equation
[C:33]([OH:34])(=[O:35])[CH3:36].[CH3:21][CH2:22][CH2:23][CH2:24][CH2:25][CH3:26].[CH3:27][CH2:28][O:29][C:30]([CH3:31])=[O:32].[OH:1][c:2]1[c:3]([C:9](=[O:10])[c:11]2[c:12]([OH:20])[cH:13][c:14]([N+:17]([O-:18])=[O:19])[cH:15][cH:16]2)[cH:4][cH:5][c:6]([OH:8])[cH:7]1>>[OH:1][c:2]1[c:3]([C:9](=[O:10])[c:11]2[c:12]([OH:20])[cH:13][c:14]([NH2:17])[cH:15][cH:16]2)[cH:4][cH:5][c:6]([OH:8])[cH:7]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 8058HexaneHCID 8857Ethyl AcetateHCID 21103677HCID 21103677, compound

Product 1

HCID 21103779HCID 21103779, compound

Sources & evidence

ORD record
ord-47144816580640a491d647f04153eecf
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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