Acetic Acid → HCID 59799078, compound

HRID 93059Notes

Reaction equation

HRID 93059 reaction equation
[CH2:53]1[O:54][CH2:55][CH2:56][CH2:57]1.[CH3:32][CH2:33][CH2:34][CH2:35][N+:36]([CH2:37][CH2:38][CH2:39][CH3:40])([CH2:41][CH2:42][CH2:43][CH3:44])[CH2:45][CH2:46][CH2:47][CH3:48].[CH3:49][C:50](=[O:51])[OH:52].[CH3:58][CH2:59][O:60][C:61]([CH3:62])=[O:63].[Cl:1][c:2]1[c:3]([N:19]2[CH2:20][CH:21]([O:23][Si:24]([C:25]([CH3:26])([CH3:27])[CH3:28])([CH3:29])[CH3:30])[CH2:22]2)[c:4]2[c:5]([cH:17][cH:18]1)[CH2:6][CH2:7][N:8]([C:11]([C:12]([F:13])([F:14])[F:15])=[O:16])[CH2:9][CH2:10]2.[F-:31]>>[Cl:1][c:2]1[c:3]([N:19]2[CH2:20][CH:21]([OH:23])[CH2:22]2)[c:4]2[c:5]([cH:17][cH:18]1)[CH2:6][CH2:7][N:8]([C:11]([C:12]([F:13])([F:14])[F:15])=[O:16])[CH2:9][CH2:10]2

Participants

7

Reactant 6

HCID 176Acetic AcidHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 16028TetrabutylammoniumHCID 28179Fluoride IonHCID 86622857HCID 86622857, compound

Product 1

HCID 59799078HCID 59799078, compound

Sources & evidence

ORD record
ord-5b58d4e2919e400e9f0f7adeb3007fff
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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