3-(Trifluoromethyl)phenylboronic acid → HCID 136949050, compound

HRID 2017004Notes

Reaction equation

HRID 2017004 reaction equation

[OH:1][CH2:2][c:3]1[n:8][cH:7][cH:6][c:5]([c:9]2[c:14]([OH:15])[cH:13][cH:12][c:11](Cl)[cH:10]2)[cH:4]1.OB([c:16]1[cH:21][c:20]([C:22]([F:25])([F:24])[F:23])[cH:19][cH:18][cH:17]1)O>>[OH:1][CH2:2][c:3]1[n:8][cH:7][cH:6][c:5]([c:9]2[c:14]([OH:15])[cH:13][cH:12][c:11]([c:16]3[cH:21][c:20]([C:22]([F:25])([F:24])[F:23])[cH:19][cH:18][cH:17]3)[cH:10]2)[cH:4]1

Participants

7

Reactant 2

HCID 27343883-(Trifluoromethyl)phenylboronic acid

HCID 136949048HCID 136949048, compound

Product 1

HCID 136949050HCID 136949050, compound

Reagents, catalysts & solvents 4

HCID 25953Cesium fluorideReagent

HCID 86278421[1,1'-bis(di-tert-butylphosphino) ferrocene]dichloropalladium(II)Catalyst

HCID 8008ButyronitrileSolvent

HCID 117669-PhenylanthraceneInternal standard

Conditions

Temperature: 110 °C

Sources & evidence

ORD record: ord-1fd41ce1b7ed4f489ff04a3b8184da02
Source dataset: 39k HTE dataset from Pfizer
DOI: 10.1038/s41557
Original link: View source

Reaction notes

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