Acetate → HCID 22248353, compound

HRID 192292Notes

Reaction equation

HRID 192292 reaction equation
[C:8]([CH3:9])([CH3:10])([CH3:11])[O:12][c:13]1[c:14]([CH2:19][N:20]2[CH2:21][CH2:22][CH:23]([CH:26]([C:27]#[N:28])[CH2:29][c:30]3[c:31]([F:36])[cH:32][cH:33][cH:34][cH:35]3)[CH2:24][CH2:25]2)[n:15][cH:16][cH:17][n:18]1.[CH2:2][CH3:3].[CH3:39][CH2:40][O:41][C:42](=[O:43])[CH3:44].[CH3:4][C:5](=[O:6])[O-:7].[ClH:1].[Na+:38].[OH-:37]>>[O:12]=[c:13]1[c:14]([CH2:19][N:20]2[CH2:21][CH2:22][CH:23]([CH:26]([C:27]#[N:28])[CH2:29][c:30]3[c:31]([F:36])[cH:32][cH:33][cH:34][cH:35]3)[CH2:24][CH2:25]2)[n:15][cH:16][cH:17][nH:18]1

Participants

8

Reactant 7

HCID 175AcetateHCID 313Hydrochloric AcidHCID 923Sodium ionHCID 961HydroxideHCID 8857Ethyl AcetateHCID 123138EthylHCID 22248171HCID 22248171, compound

Product 1

HCID 22248353HCID 22248353, compound

Sources & evidence

ORD record
ord-761ded0deaa044ed8d9a6fd26147f273
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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