Ethanol → HCID 66589203, compound

HRID 319689Notes

Reaction equation

HRID 319689 reaction equation
[C:33](=[O:34])([O-:35])[O-:36].[CH3:39][c:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1.[CH3:46][CH2:47][OH:48].[CH:1]12[CH2:2][N:3]([c:9]3[c:10]4[c:11]([n:12][c:13]([Cl:15])[n:14]3)[n:16]([CH2:19][CH2:20][C:21]#[N:22])[n:17][cH:18]4)[CH2:4][CH:5]([CH2:6][CH2:7]1)[O:8]2.[NH2:23][c:24]1[cH:25][cH:26][c:27]([B:30]([OH:31])[OH:32])[cH:28][cH:29]1.[Na+:37].[Na+:38]>>[CH:1]12[CH2:2][N:3]([c:9]3[c:10]4[c:11]([n:12][c:13](-[c:27]5[cH:26][cH:25][c:24]([NH2:23])[cH:29][cH:28]5)[n:14]3)[n:16]([CH2:19][CH2:20][C:21]#[N:22])[n:17][cH:18]4)[CH2:4][CH:5]([CH2:6][CH2:7]1)[O:8]2

Participants

7

Reactant 6

HCID 702EthanolHCID 923Sodium ion2×HCID 1140TolueneHCID 19660Carbonate IonHCID 27346154-Aminophenylboronic acidHCID 86761507HCID 86761507, compound

Product 1

HCID 66589203HCID 66589203, compound

Sources & evidence

ORD record
ord-e4caced963314965b97c1b3c99da5e0c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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