Acetate → HCID 15190126, compound

HRID 164110Notes

Reaction equation

HRID 164110 reaction equation
[CH3:2][C:3]([O-:4])=[O:5].[F:6][c:7]1[c:8]([C:14]2([C:17]([CH3:18])([CH3:19])[S:20][CH2:21][c:22]3[cH:23][cH:24][c:25]([O:28][CH3:29])[cH:26][cH:27]3)[O:15][CH2:16]2)[cH:9][cH:10][c:11]([F:13])[cH:12]1.[K+:1].[O:30]1[CH2:31][CH2:32][O:33][CH2:34][CH2:35][O:36][CH2:37][CH2:38][O:39][CH2:40][CH2:41][O:42][CH2:43][CH2:44][O:45][CH2:46][CH2:47]1.[OH2:48]>>[OH:4][C:14]([c:8]1[c:7]([F:6])[cH:12][c:11]([F:13])[cH:10][cH:9]1)([CH2:16][OH:15])[C:17]([CH3:18])([CH3:19])[S:20][CH2:21][c:22]1[cH:23][cH:24][c:25]([O:28][CH3:29])[cH:26][cH:27]1

Participants

6

Reactant 5

HCID 175AcetateHCID 813Potassium CationHCID 962WaterHCID 2855718-Crown-6HCID 19024387HCID 19024387, compound

Product 1

HCID 15190126HCID 15190126, compound

Sources & evidence

ORD record
ord-032b8c6118944bbb8da35ac60bc03b3c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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