Acetic Acid → HCID 9828153, compound

HRID 2126855Notes

Reaction equation

HRID 2126855 reaction equation
[Br:27][c:28]1[cH:29][cH:30][c:31]([CH:32]=[O:33])[cH:34][cH:35]1.[C:36]([BH3-:37])#[N:38].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[n:8]1[c:9]([CH:18]([CH2:19][CH3:20])[NH:21][CH2:22][CH2:23][N:24]([CH3:25])[CH3:26])[n:10][c:11]2[c:12]([c:13]1=[O:14])[cH:15][cH:16][o:17]2.[CH3:45][OH:46].[CH3:47][C:48](=[O:49])[OH:50].[Na+:39].[O:40]1[CH2:41][CH2:42][CH2:43][CH2:44]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[n:8]1[c:9]([CH:18]([CH2:19][CH3:20])[N:21]([CH2:22][CH2:23][N:24]([CH3:25])[CH3:26])[CH2:32][c:31]2[cH:30][cH:29][c:28]([Br:27])[cH:35][cH:34]2)[n:10][c:11]2[c:12]([c:13]1=[O:14])[cH:15][cH:16][o:17]2

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 887MethanolHCID 923Sodium ionHCID 8028TetrahydrofuranHCID 707414-BromobenzaldehydeHCID 498716Cyano-borohydrideHCID 58909203HCID 58909203, compound

Product 1

HCID 9828153HCID 9828153, compound

Sources & evidence

ORD record
ord-ce1bb34005a847a18a3aa8d47b64cec3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

Loading…