Ethanol → HCID 21936724, compound

HRID 1127356Notes

Reaction equation

HRID 1127356 reaction equation
[BH4-:39].[CH3:50][C:51]([Cl:52])=[O:53].[CH3:54][CH2:55][OH:56].[CH:41]([N:42]([CH:43]([CH3:44])[CH3:45])[CH2:46][CH3:47])([CH3:48])[CH3:49].[Cl:57][CH2:58][Cl:59].[NH2:1][c:2]1[c:3]([C:21](=[O:22])[OH:23])[c:4]2[c:5]([s:20]1)[CH:6]([CH2:18][NH2:19])[N:7]([CH:10]([CH3:11])[c:12]1[cH:13][cH:14][cH:15][cH:16][cH:17]1)[CH2:8][CH2:9]2.[Na+:40].[O:24]([c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1)[c:31]1[cH:32][cH:33][c:34]([CH:35]=[O:36])[cH:37][cH:38]1>>[NH2:1][c:2]1[c:3]([C:21](=[O:22])[OH:23])[c:4]2[c:5]([s:20]1)[CH:6]([CH2:18][N:19]([CH2:35][c:34]1[cH:33][cH:32][c:31]([O:24][c:25]3[cH:26][cH:27][cH:28][cH:29][cH:30]3)[cH:38][cH:37]1)[C:51]([CH3:50])=[O:53])[N:7]([CH:10]([CH3:11])[c:12]1[cH:13][cH:14][cH:15][cH:16][cH:17]1)[CH2:8][CH2:9]2

Participants

9

Reactant 8

HCID 702EthanolHCID 923Sodium ionHCID 6344DichloromethaneHCID 6367Acetyl chlorideHCID 28123BorohydrideHCID 661394-PhenoxybenzaldehydeHCID 81531DiisopropylethylamineHCID 21936682HCID 21936682, compound

Product 1

HCID 21936724HCID 21936724, compound

Sources & evidence

ORD record
ord-4141896954fc47618b2f2ac6488e1bae
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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