Acetic Acid → HCID 20541499, compound

Reaction equation

[C:41]([OH:42])(=[O:43])[CH3:44].[CH3:26][CH2:27][O:28][C:29](=[O:30])[CH3:31].[Cl:32][CH2:33][Cl:34].[Na+:25].[O-:21][C:22]([OH:23])=[O:24].[O:1]=[C:2]1[CH:3]2[C:4]3([CH3:20])[CH:5]=[CH:6][CH:7]([C:8]([CH3:17])([CH3:18])[C:9]3([O:12][Si:13]([CH3:14])([CH3:15])[CH3:16])[CH2:10][CH2:11]1)[CH2:19]2.[O:36]1[CH2:37][CH2:38][CH2:39][CH2:40]1.[OH2:35]>>[O:1]=[C:2]1[CH:3]2[C:4]3([CH3:20])[CH:5]=[CH:6][CH:7]([C:8]([CH3:17])([CH3:18])[C:9]3([OH:12])[CH2:10][CH2:11]1)[CH2:19]2

Participants

Reactant 8

HCID 176Acetic Acid

HCID 769Bicarbonate Ion

HCID 923Sodium Ion

HCID 962Water

HCID 6344Dichloromethane

HCID 8028Tetrahydrofuran

HCID 8857Ethyl Acetate

HCID 20541496HCID 20541496, compound

Product 1

Sources & evidence

ORD record: ord-16478922056d4304b78bcef19267264c
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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