Acetic Acid → HCID 57546102, compound

HRID 1139348Notes

Reaction equation

HRID 1139348 reaction equation
[C:30]([BH3-:31])#[N:32].[CH3:34][C:35](=[O:36])[OH:37].[CH3:38][C:39]#[N:40].[Na+:33].[c:1]1([C:7]2([CH2:13][O:14][CH:15]([CH3:16])[c:17]3[cH:18][c:19]([C:26]([F:27])([F:28])[F:29])[cH:20][c:21]4[cH:22][n:23][nH:24][c:25]34)[CH2:8][CH2:9][NH:10][CH2:11][CH2:12]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([C:7]2([CH2:13][O:14][CH:15]([CH3:16])[c:17]3[cH:18][c:19]([C:26]([F:27])([F:28])[F:29])[cH:20][c:21]4[cH:22][n:23][nH:24][c:25]34)[CH2:8][CH2:9][N:10]([CH3:30])[CH2:11][CH2:12]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 923Sodium ionHCID 6342AcetonitrileHCID 498716Cyano-borohydrideHCID 25159918HCID 25159918, compound

Product 1

HCID 57546102HCID 57546102, compound

Sources & evidence

ORD record
ord-a6a1e93084b140d683ab33bc8a5822a1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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