Acetic Acid → HCID 18615146, compound

HRID 1554708Notes

Reaction equation

HRID 1554708 reaction equation
[CH2:50]([N+:51]([CH2:52][CH2:53][CH2:54][CH3:55])([CH2:56][CH2:57][CH2:58][CH3:59])[CH2:60][CH2:61][CH2:62][CH3:63])[CH2:64][CH2:65][CH3:66].[CH3:72][C:73](=[O:74])[OH:75].[CH3:76][CH2:77][O:78][C:79](=[O:80])[CH3:81].[F-:49].[O:67]1[CH2:68][CH2:69][CH2:70][CH2:71]1.[cH:1]1[cH:2][c:3]([O:14][CH2:15][CH2:16][NH:17][CH2:18][CH:19]([O:20][Si:21]([CH2:22][CH3:23])([CH2:24][CH3:25])[CH2:26][CH3:27])[c:28]2[cH:29][cH:30][c:31]([O:41][CH2:42][c:43]3[cH:44][cH:45][cH:46][cH:47][cH:48]3)[c:32]([NH:34][S:35](=[O:36])(=[O:37])[N:38]([CH3:39])[CH3:40])[cH:33]2)[cH:4][c:5]2[o:6][c:7]3[c:8]([c:9]12)[cH:10][cH:11][cH:12][cH:13]3>>[cH:1]1[cH:2][c:3]([O:14][CH2:15][CH2:16][NH:17][CH2:18][CH:19]([OH:20])[c:28]2[cH:29][cH:30][c:31]([O:41][CH2:42][c:43]3[cH:44][cH:45][cH:46][cH:47][cH:48]3)[c:32]([NH:34][S:35](=[O:36])(=[O:37])[N:38]([CH3:39])[CH3:40])[cH:33]2)[cH:4][c:5]2[o:6][c:7]3[c:8]([c:9]12)[cH:10][cH:11][cH:12][cH:13]3

Participants

7

Reactant 6

HCID 176Acetic AcidHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 16028TetrabutylammoniumHCID 28179Fluoride IonHCID 18615195HCID 18615195, compound

Product 1

HCID 18615146HCID 18615146, compound

Sources & evidence

ORD record
ord-e4717341c08f43cf9e41bab4c2216d3f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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