Acetone → HCID 12393678, compound

HRID 2326794Notes

Reaction equation

HRID 2326794 reaction equation
[C:34]([BH3-:35])#[N:36].[CH3:1][C:2]([CH3:3])=[O:4].[CH3:40][OH:41].[Cl-:39].[ClH:5].[Li+:37].[NH2:6][CH:7]1[CH:8]([OH:27])[c:9]2[cH:10][cH:11][c:12]([O:19][CH2:20][c:21]3[cH:22][cH:23][cH:24][cH:25][cH:26]3)[c:13]([C:17]#[N:18])[c:14]2[CH2:15][CH2:16]1.[Na+:38].[O:28]1[CH2:29][CH2:30][O:31][CH2:32][CH2:33]1>>[CH3:1][CH:2]([CH3:3])[NH:6][CH:7]1[CH:8]([OH:27])[c:9]2[cH:10][cH:11][c:12]([O:19][CH2:20][c:21]3[cH:22][cH:23][cH:24][cH:25][cH:26]3)[c:13]([C:17]#[N:18])[c:14]2[CH2:15][CH2:16]1

Participants

10

Reactant 9

HCID 180AcetoneHCID 312ChlorideHCID 313Hydrochloric AcidHCID 887MethanolHCID 923Sodium ionHCID 28486Lithium ionHCID 312751,4-DioxaneHCID 498716Cyano-borohydrideHCID 12393668HCID 12393668, compound

Product 1

HCID 12393678HCID 12393678, compound

Sources & evidence

ORD record
ord-657d2a4f787c475e990f05748bbb1fa4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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