Acetic Acid → HCID 67681290, compound

HRID 662270Notes

Reaction equation

HRID 662270 reaction equation
[BrH:39].[C:1]([BH3-:2])#[N:3].[CH2:5]([c:6]1[cH:7][cH:8][cH:9][cH:10][cH:11]1)[O:12][c:13]1[c:14]([O:33][CH3:34])[cH:15][c:16]2[c:21]([cH:22]1)[C:20]([C:23]1([c:27]3[c:28]([CH3:32])[s:29][cH:30][cH:31]3)[CH2:24][CH2:25][CH2:26]1)=[N:19][CH2:18][CH2:17]2.[CH3:35][C:36](=[O:37])[OH:38].[CH3:40][CH:41]([OH:42])[CH3:43].[CH3:44][OH:45].[Na+:4]>>[CH2:5]([c:6]1[cH:7][cH:8][cH:9][cH:10][cH:11]1)[O:12][c:13]1[c:14]([O:33][CH3:34])[cH:15][c:16]2[c:21]([cH:22]1)[CH:20]([C:23]1([c:27]3[c:28]([CH3:32])[s:29][cH:30][cH:31]3)[CH2:24][CH2:25][CH2:26]1)[NH:19][CH2:18][CH2:17]2

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 260Hydrogen BromideHCID 887MethanolHCID 923Sodium ionHCID 3776IsopropanolHCID 498716Cyano-borohydrideHCID 67681279HCID 67681279, compound

Product 1

HCID 67681290HCID 67681290, compound

Sources & evidence

ORD record
ord-777f0371cc1843f68663ee3f05f4a63b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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