Acetic Acid → 5-Trifluoromethyl-2-(2-phenylchroman-6-yloxy)-aniline

HRID 1117513Notes

Reaction equation

HRID 1117513 reaction equation
[CH3:55][C:56](=[O:57])[OH:58].[N+:1]([O-:2])(=[O:3])[c:4]1[c:5]([O:14][c:15]2[cH:16][c:17]3[c:22]([cH:23][cH:24]2)[O:21][CH:20]([c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)[CH2:19][CH2:18]3)[cH:6][cH:7][c:8]([C:10]([F:11])([F:12])[F:13])[cH:9]1.[Zn:59].[c:31]1([CH:32]2[CH2:33][CH2:34][c:35]3[c:36]([cH:37][cH:38][c:39]([O:40][c:41]4[cH:42][cH:43][cH:44][cH:45][c:46]4[NH2:47])[cH:48]3)[O:49]2)[cH:50][cH:51][cH:52][cH:53][cH:54]1>>[NH2:1][c:4]1[c:5]([O:14][c:15]2[cH:16][c:17]3[c:22]([cH:23][cH:24]2)[O:21][CH:20]([c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)[CH2:19][CH2:18]3)[cH:6][cH:7][c:8]([C:10]([F:11])([F:12])[F:13])[cH:9]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 23994ZincHCID 179785582-(2-Phenylchroman-6-yloxy)-anilineHCID 179786542-Nitro-1-(2-phenylchroman-6-yloxy)-4-trifluoromethylbenzene

Product 1

HCID 179785005-Trifluoromethyl-2-(2-phenylchroman-6-yloxy)-aniline

Sources & evidence

ORD record
ord-9a47df47de254558aa4f21ac77c1a907
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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