Acetic Acid → HCID 17989627, compound

HRID 196356Notes

Reaction equation

HRID 196356 reaction equation
[CH2:8]([CH3:9])[C:10]12[C:11](=[O:29])[CH2:12][CH2:13][CH:14]1[CH:15]1[CH:16]([CH:17]([OH:19])[CH2:18]2)[CH:20]2[CH2:21][CH2:22][C:23](=[O:28])[CH:24]=[C:25]2[CH2:26][CH2:27]1.[CH3:36][C:37](=[O:38])[OH:39].[Cl:33][CH2:34][Cl:35].[Na+:31].[OH-:30].[OH2:32].[OH:1][C:2]([C:3]([F:4])([F:5])[F:6])=[O:7]>>[CH2:8]([CH3:9])[C:10]12[C:11](=[O:29])[CH2:12][CH2:13][CH:14]1[CH:15]1[CH:16]([CH:17]([OH:19])[CH2:18]2)[CH:20]2[CH2:21][CH2:22][CH2:23][CH:24]=[C:25]2[CH2:26][CH2:27]1

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 15765681HCID 15765681, compound

Product 1

HCID 17989627HCID 17989627, compound

Sources & evidence

ORD record
ord-5857cff7bfa349abb14f94db9e36338c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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