[2-Chloro-4-(trifluoromethyl)phenyl]boronic acid → Tert-butyl 7-[2-chloro-4-(trifluoromethyl)phenyl]-1,12-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-5(16),6,8-triene-12-carboxylate

HRID 182242Notes

Reaction equation

HRID 182242 reaction equation
[Br:1][c:2]1[cH:3][c:4]2[c:9]3[c:10]([cH:11]1)[CH:12]1[CH:13]([N:8]3[CH2:7][CH2:6][CH2:5]2)[CH2:14][CH2:15][N:16]([C:18](=[O:19])[O:20][C:21]([CH3:22])([CH3:23])[CH3:24])[CH2:17]1.[Cl:25][c:26]1[c:27]([B:36]([OH:37])[OH:38])[cH:28][cH:29][c:30]([C:32]([F:33])([F:34])[F:35])[cH:31]1>>[c:2]1(-[c:27]2[c:26]([Cl:25])[cH:31][c:30]([C:32]([F:33])([F:34])[F:35])[cH:29][cH:28]2)[cH:3][c:4]2[c:9]3[c:10]([cH:11]1)[CH:12]1[CH:13]([N:8]3[CH2:7][CH2:6][CH2:5]2)[CH2:14][CH2:15][N:16]([C:18](=[O:19])[O:20][C:21]([CH3:22])([CH3:23])[CH3:24])[CH2:17]1

Participants

3

Reactant 2

HCID 2783251[2-Chloro-4-(trifluoromethyl)phenyl]boronic acidHCID 10046076Tert-butyl 7-bromo-1,12-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-5(16),6,8-triene-12-carboxylate

Product 1

HCID 10141354Tert-butyl 7-[2-chloro-4-(trifluoromethyl)phenyl]-1,12-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-5(16),6,8-triene-12-carboxylate

Sources & evidence

ORD record
ord-c4e9ed885af44daca8a31b54f07b9e03
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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