Water → Ethyl 1-(6-amino-5-(cyclopropylmethoxy)-4'-(trifluoromethyl)biphenyl-3-yl)cyclopentanecarboxylate

HRID 701967Notes

Reaction equation

HRID 701967 reaction equation
[CH3:37][CH2:38][O:39][C:40]([CH3:41])=[O:42].[CH3:44][O:45][CH2:46][CH2:47][O:48][CH3:49].[F:24][C:25]([c:26]1[cH:27][cH:28][c:29]([B:32]([OH:33])[OH:34])[cH:30][cH:31]1)([F:35])[F:36].[NH2:1][c:2]1[c:3]([Br:23])[cH:4][c:5]([C:13]2([C:18](=[O:19])[O:20][CH2:21][CH3:22])[CH2:14][CH2:15][CH2:16][CH2:17]2)[cH:6][c:7]1[O:8][CH2:9][CH:10]1[CH2:11][CH2:12]1.[OH2:43]>>[NH2:1][c:2]1[c:3](-[c:29]2[cH:28][cH:27][c:26]([C:25]([F:24])([F:35])[F:36])[cH:31][cH:30]2)[cH:4][c:5]([C:13]2([C:18](=[O:19])[O:20][CH2:21][CH3:22])[CH2:14][CH2:15][CH2:16][CH2:17]2)[cH:6][c:7]1[O:8][CH2:9][CH:10]1[CH2:11][CH2:12]1

Participants

6

Reactant 5

HCID 962WaterHCID 80711,2-DimethoxyethaneHCID 8857Ethyl AcetateHCID 27343894-(Trifluoromethyl)phenylboronic acidHCID 57995561HCID 57995561, compound

Product 1

HCID 57995494Ethyl 1-(6-amino-5-(cyclopropylmethoxy)-4'-(trifluoromethyl)biphenyl-3-yl)cyclopentanecarboxylate

Sources & evidence

ORD record
ord-120b2938415640dbb408cea5086d07db
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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