Acetic Acid → HCID 69517313, compound

HRID 1560426Notes

Reaction equation

HRID 1560426 reaction equation
[C:29]([BH3-:30])#[N:31].[C:35]([OH:36])(=[O:37])[CH3:38].[CH2:25]([CH2:26][CH3:27])[NH2:28].[CH2:39]1[O:40][CH2:41][CH2:42][CH2:43]1.[CH3:1][C:2]([CH:3]=[O:4])([CH3:5])[c:6]1[cH:7][cH:8][c:9]2[c:14]([cH:15]1)[O:13][CH:12]([C:16]([F:17])([F:18])[F:19])[C:11]([C:20](=[O:21])[O:22][CH2:23][CH3:24])=[CH:10]2.[CH3:33][OH:34].[Na+:32]>>[CH3:1][C:2]([CH2:3][NH:28][CH2:25][CH2:26][CH3:27])([CH3:5])[c:6]1[cH:7][cH:8][c:9]2[c:14]([cH:15]1)[O:13][CH:12]([C:16]([F:17])([F:18])[F:19])[C:11]([C:20](=[O:21])[O:22][CH2:23][CH3:24])=[CH:10]2

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 887MethanolHCID 923Sodium ionHCID 7852PropylamineHCID 8028TetrahydrofuranHCID 498716Cyano-borohydrideHCID 86599474HCID 86599474, compound

Product 1

HCID 69517313HCID 69517313, compound

Sources & evidence

ORD record
ord-863c753ede1144f5adc93b8dcf68f8dc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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