Acetic Acid → HCID 24859534, compound

HRID 1561560Notes

Reaction equation

HRID 1561560 reaction equation
[C:37]([OH:38])(=[O:39])[CH3:40].[C:41]([BH3-:42])#[N:43].[CH2:26]([O:27][C:29]1([O:28][Si:32]([CH3:33])([CH3:34])[CH3:35])[CH2:30][CH2:31]1)[CH3:36].[CH3:45][OH:46].[CH3:47][CH2:48][O:49][C:50]([CH3:51])=[O:52].[CH:1]1([N:4]([C:5]([c:6]2[cH:7][cH:8][c:9]([C:12]([C:13]([F:14])([F:15])[F:16])([CH3:17])[OH:18])[cH:10][cH:11]2)=[O:19])[CH:20]2[CH2:21][CH2:22][NH:23][CH2:24][CH2:25]2)[CH2:2][CH2:3]1.[Na+:44]>>[CH:1]1([N:4]([C:5]([c:6]2[cH:7][cH:8][c:9]([C:12]([C:13]([F:14])([F:15])[F:16])([CH3:17])[OH:18])[cH:10][cH:11]2)=[O:19])[CH:20]2[CH2:21][CH2:22][N:23]([CH:29]3[CH2:30][CH2:31]3)[CH2:24][CH2:25]2)[CH2:2][CH2:3]1

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 887MethanolHCID 923Sodium ionHCID 8857Ethyl AcetateHCID 498716Cyano-borohydrideHCID 2734686(1-Ethoxycyclopropoxy)trimethylsilaneHCID 68428683HCID 68428683, compound

Product 1

HCID 24859534HCID 24859534, compound

Sources & evidence

ORD record
ord-fa9844c74282424ba50f657de7fe97bf
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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