Acetic Acid → HCID 86653598, compound

HRID 1127666Notes

Reaction equation

HRID 1127666 reaction equation
[C:1]([Si:2]([c:3]1[cH:4][cH:5][cH:30][cH:31][cH:32]1)([O:6][CH2:7][CH:8]1[CH2:9][CH:10]=[C:11]([C:26](=[O:27])[O:28][CH3:29])[C:12]([CH3:14])([c:15]2[cH:16][c:17]([C:22]([F:23])([F:24])[F:25])[c:18]([Cl:21])[cH:19][cH:20]2)[CH2:13]1)[c:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1)([CH3:39])([CH3:40])[CH3:41].[CH2:64]1[O:65][CH2:66][CH2:67][CH2:68]1.[CH3:42][C:43](=[O:44])[OH:45].[CH3:47][CH2:48][CH2:49][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].[CH3:69][CH2:70][O:71][C:72](=[O:73])[CH3:74].[F-:46]>>[OH:6][CH2:7][CH:8]1[CH2:9][CH:10]=[C:11]([C:26](=[O:27])[O:28][CH3:29])[C:12]([CH3:14])([c:15]2[cH:16][c:17]([C:22]([F:23])([F:24])[F:25])[c:18]([Cl:21])[cH:19][cH:20]2)[CH2:13]1

Participants

7

Reactant 6

HCID 176Acetic AcidHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 16028TetrabutylammoniumHCID 28179Fluoride IonHCID 86653596HCID 86653596, compound

Product 1

HCID 86653598HCID 86653598, compound

Sources & evidence

ORD record
ord-1fcd665849e543b2b2c7a9f1cfbfd85a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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