Acetate → HCID 76618356, compound

HRID 185515Notes

Reaction equation

HRID 185515 reaction equation
[CH2:42]1[O:43][CH2:44][CH2:45][CH2:46]1.[CH3:34][C:35](=[O:36])[O-:37].[CH3:38][CH2:39][OH:40].[ClH:30].[ClH:41].[K+:33].[NH2:1][c:2]1[c:3]([O:18][CH:19]([CH3:20])[c:21]2[c:22]([Cl:29])[c:23]([F:28])[cH:24][cH:25][c:26]2[Cl:27])[c:4]2[c:5]([cH:6][n:7]1)[c:8](-[c:11]1[cH:12][c:13]([CH:16]=[O:17])[s:14][cH:15]1)[cH:9][o:10]2.[NH2:31][OH:32].[OH2:47].[Zn:48]>>[NH2:1][c:2]1[c:3]([O:18][CH:19]([CH3:20])[c:21]2[c:22]([Cl:29])[c:23]([F:28])[cH:24][cH:25][c:26]2[Cl:27])[c:4]2[c:5]([cH:6][n:7]1)[c:8](-[c:11]1[cH:12][c:13]([CH2:16][NH2:31])[s:14][cH:15]1)[cH:9][o:10]2

Participants

10

Reactant 9

HCID 175AcetateHCID 313Hydrochloric Acid2×HCID 702EthanolHCID 787HydroxylamineHCID 813Potassium CationHCID 962WaterHCID 8028TetrahydrofuranHCID 23994ZincHCID 76618448HCID 76618448, compound

Product 1

HCID 76618356HCID 76618356, compound

Sources & evidence

ORD record
ord-7c3a3126651e440ca9d9010240b22a84
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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