Ammonium → HCID 68446294, compound

HRID 211008Notes

Reaction equation

HRID 211008 reaction equation
[B:19]([F:20])([F:21])[F:22].[Br:1][c:2]1[c:3]([F:8])[cH:4][cH:5][cH:6][cH:7]1.[CH2:14]([O:15][CH2:16][CH3:17])[CH3:18].[CH2:56]1[O:57][CH2:58][CH2:59][CH2:60]1.[CH2:9]([Li:10])[CH2:11][CH2:12][CH3:13].[CH3:23][O:24][CH:25]1[CH2:26][CH2:27][CH:28]2[C:29](=[N:30][O:31][CH2:32]2)[CH2:33]1.[CH3:36][CH2:37][CH2:38][CH2:39][CH2:40][CH3:41].[CH3:42][c:43]1[cH:44][cH:45][cH:46][cH:47][cH:48]1.[CH3:50][CH2:51][O:52][C:53](=[O:54])[CH3:55].[Cl-:34].[NH4+:35].[OH2:49]>>[c:2]1([C:29]23[CH:28]([CH2:27][CH2:26][CH:25]([O:24][CH3:23])[CH2:33]2)[CH2:32][O:31][NH:30]3)[c:3]([F:8])[cH:4][cH:5][cH:6][cH:7]1

Participants

13

Reactant 12

HCID 223AmmoniumHCID 312ChlorideHCID 962WaterHCID 1140TolueneHCID 3283Diethyl EtherHCID 6356Boron trifluorideHCID 8028TetrahydrofuranHCID 8058HexaneHCID 8857Ethyl AcetateHCID 612591-Bromo-2-fluorobenzeneHCID 68444937HCID 68444937, compoundHCID 178418339Butyllithium

Product 1

HCID 68446294HCID 68446294, compound

Sources & evidence

ORD record
ord-7f906880416f4898986bf39c3694ba80
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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