Methanol → HCID 178481417, compound

HRID 308434Notes

Reaction equation

HRID 308434 reaction equation
[CH3:1][N:2]1[C:3](=[O:18])[CH2:4][CH2:5][C:6]2([CH3:17])[c:7]3[c:8]([cH:12][c:13]([Br:16])[cH:14][cH:15]3)[CH2:9][CH2:10][CH:11]12.[CH3:36][c:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1.[CH3:46][OH:47].[Cl:19][c:20]1[cH:21][c:22]([B:27]([OH:28])[OH:29])[cH:23][cH:24][c:25]1[F:26].[Cl:43][CH2:44][Cl:45].[Na+:30].[Na+:31].[O-:32][C:33](=[O:34])[O-:35]>>[CH3:1][N:2]1[C:3](=[O:18])[CH2:4][CH2:5][C:6]2([CH3:17])[c:7]3[c:8]([cH:12][c:13](-[c:22]4[cH:21][c:20]([Cl:19])[c:25]([F:26])[cH:24][cH:23]4)[cH:14][cH:15]3)[CH2:9][CH2:10][CH:11]12

Participants

8

Reactant 7

HCID 887MethanolHCID 923Sodium ion2×HCID 1140TolueneHCID 6344DichloromethaneHCID 19660Carbonate IonHCID 27346603-Chloro-4-fluorophenylboronic Acid (contains varying amounts of Anhydride)HCID 221252194-Methyl-8-bromo-10b-methyl-1,2,3,4,4a, 5,6,10b-octahydrobenzo[f]quinolin-3-one

Product 1

HCID 178481417HCID 178481417, compound

Sources & evidence

ORD record
ord-20759a88907b43f199276f6df6018595
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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