Acetic Acid → HCID 178519635, compound

HRID 684573Notes

Reaction equation

HRID 684573 reaction equation
[C:38]([O:39][BH-:40]([O:41][C:42](=[O:43])[CH3:44])[O:45][C:46](=[O:47])[CH3:48])(=[O:49])[CH3:50].[CH3:54][C:55](=[O:56])[OH:57].[F:1][C:2]([c:3]1[cH:4][c:5]([C:6](=[O:7])[N:8]2[CH2:9][CH:10]3[N:11]([CH2:12][CH:13]2[CH2:14][c:15]2[cH:16][nH:17][c:18]4[cH:19][cH:20][cH:21][cH:22][c:23]24)[CH2:24][C:25](=[O:28])[CH2:26][CH2:27]3)[cH:29][c:30]([C:32]([F:33])([F:34])[F:35])[cH:31]1)([F:36])[F:37].[Na+:51].[Na+:53].[OH-:52].[OH2:58]>>[F:1][C:2]([c:3]1[cH:4][c:5]([C:6](=[O:7])[N:8]2[CH2:9][CH:10]3[N:11]([CH2:12][CH:13]2[CH2:14][c:15]2[cH:16][nH:17][c:18]4[cH:19][cH:20][cH:21][cH:22][c:23]24)[CH2:24][CH:25]([OH:28])[CH2:26][CH2:27]3)[cH:29][c:30]([C:32]([F:33])([F:34])[F:35])[cH:31]1)([F:36])[F:37]

Participants

7

Reactant 6

HCID 176Acetic AcidHCID 923Sodium ion2×HCID 961HydroxideHCID 962WaterHCID 2724942TriacetoxyborohydrideHCID 178515723HCID 178515723, compound

Product 1

HCID 178519635HCID 178519635, compound

Sources & evidence

ORD record
ord-51dd99cf9d424e28afad631ec71e3eda
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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