Acetone → 4,5-Difluoro-2-methoxy-4'-(3-nitro-benzyloxy)-biphenyl

HRID 2339033Notes

Reaction equation

HRID 2339033 reaction equation
[Br:1][CH2:2][c:3]1[cH:4][c:5]([N+:9](=[O:10])[O-:11])[cH:6][cH:7][cH:8]1.[C:29](=[O:30])([O-:31])[O-:32].[CH3:60][C:61](=[O:62])[CH3:63].[F:12][c:13]1[cH:14][c:15]([O:27][CH3:28])[c:16](-[c:20]2[cH:21][cH:22][c:23]([OH:26])[cH:24][cH:25]2)[cH:17][c:18]1[F:19].[F:35][c:36]1[cH:37][c:38]([F:39])[cH:40][cH:41][c:42]1-[c:43]1[cH:44][cH:45][c:46]([O:47][CH2:48][c:49]2[cH:50][cH:51][cH:52][c:53]([N+:54]([O-:55])=[O:56])[cH:57]2)[cH:58][cH:59]1.[K+:33].[K+:34]>>[CH2:2]([c:3]1[cH:4][c:5]([N+:9](=[O:10])[O-:11])[cH:6][cH:7][cH:8]1)[O:26][c:23]1[cH:22][cH:21][c:20](-[c:16]2[c:15]([O:27][CH3:28])[cH:14][c:13]([F:12])[c:18]([F:19])[cH:17]2)[cH:25][cH:24]1

Participants

7

Reactant 6

HCID 180AcetoneHCID 813Potassium Cation2×HCID 19660Carbonate IonHCID 77568Benzene, 1-(bromomethyl)-3-nitro-HCID 582599934',5'-Difluoro-2'-methoxy-biphenyl-4-olHCID 582877952,4-Difluoro-4'-(3-nitro-benzyloxy)-biphenyl

Product 1

HCID 582877964,5-Difluoro-2-methoxy-4'-(3-nitro-benzyloxy)-biphenyl

Sources & evidence

ORD record
ord-56c8765b55ed42c8a48c93e39e96e078
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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