Hydrochloric Acid → HCID 16660652, compound

HRID 2349898Notes

Reaction equation

HRID 2349898 reaction equation
[CH2:37]1[O:38][CH2:39][CH2:40][O:41][CH2:42]1.[CH2:43]1[O:44][CH2:45][CH2:46][O:47][CH2:48]1.[CH3:49][CH2:50][O:51][C:52](=[O:53])[CH3:54].[ClH:36].[F:1][c:2]1[cH:3][cH:4][c:5]([CH3:35])[c:6]([O:7][CH2:8][c:9]2[c:10]3[c:15]([cH:16][cH:17][c:18]2-[c:19]2[c:20]([O:29][CH3:30])[cH:21][c:22]([O:25][CH2:26][O:27][CH3:28])[cH:23][cH:24]2)[NH:14][C:13]([CH3:31])([CH3:32])[CH:12]=[C:11]3[CH3:33])[cH:34]1>>[F:1][c:2]1[cH:3][cH:4][c:5]([CH3:35])[c:6]([O:7][CH2:8][c:9]2[c:10]3[c:15]([cH:16][cH:17][c:18]2-[c:19]2[c:20]([O:29][CH3:30])[cH:21][c:22]([OH:25])[cH:23][cH:24]2)[NH:14][C:13]([CH3:31])([CH3:32])[CH:12]=[C:11]3[CH3:33])[cH:34]1

Participants

5

Reactant 4

HCID 313Hydrochloric AcidHCID 8857Ethyl AcetateHCID 312751,4-Dioxane2×HCID 58027129HCID 58027129, compound

Product 1

HCID 16660652HCID 16660652, compound

Sources & evidence

ORD record
ord-72eb3d35ced545d2bd980ab8b85fe1ea
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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