Acetic Acid → HCID 59835866, compound

HRID 289007Notes

Reaction equation

HRID 289007 reaction equation
[BH4-:37].[CH3:39][C:40](=[O:41])[OH:42].[CH3:43][OH:44].[CH:1]1([CH:4]=[O:5])[CH2:2][CH2:3]1.[Cl:6][c:7]1[cH:8][cH:9][c:10](-[c:13]2[cH:14][cH:15][c:16]([C:19]#[C:20][c:21]3[cH:22][c:23]4[cH:24][cH:25][n:26]([CH2:30][CH2:31][NH:32][CH2:33][CH:34]5[CH2:35][CH2:36]5)[c:27]4[cH:28][cH:29]3)[n:17][cH:18]2)[cH:11][cH:12]1.[Na+:38]>>[CH:1]1([CH2:4][N:32]([CH2:31][CH2:30][n:26]2[cH:25][cH:24][c:23]3[cH:22][c:21]([C:20]#[C:19][c:16]4[cH:15][cH:14][c:13](-[c:10]5[cH:9][cH:8][c:7]([Cl:6])[cH:12][cH:11]5)[cH:18][n:17]4)[cH:29][cH:28][c:27]32)[CH2:33][CH:34]2[CH2:35][CH2:36]2)[CH2:2][CH2:3]1

Participants

7

Reactant 6

HCID 176Acetic AcidHCID 887MethanolHCID 923Sodium ionHCID 28123BorohydrideHCID 123114CyclopropanecarboxaldehydeHCID 59835834(2-{5-[5-(4-Chloro-phenyl)-pyridin-2-ylethynyl]-indol-1-yl}-ethyl)-cyclopropylmethyl-amine

Product 1

HCID 59835866HCID 59835866, compound

Sources & evidence

ORD record
ord-eb5d1e3c9314420f9e5b34b93016422b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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