Ammonium → HCID 77274919, compound

HRID 1220865Notes

Reaction equation

HRID 1220865 reaction equation
[Br-:13].[Br:1][c:2]1[cH:3][c:4]([F:10])[c:5]([F:9])[c:6]([F:8])[cH:7]1.[C:24]([CH3:25])([CH3:26])([CH3:27])[O:28][C:29](=[O:30])[N:31]1[CH:32]([CH2:38][O:39][CH2:40][c:41]2[cH:42][cH:43][cH:44][cH:45][cH:46]2)[CH2:33][O:34][CH2:35][C:36]1=[O:37].[CH3:49][c:50]1[cH:51][cH:52][cH:53][cH:54][cH:55]1.[CH3:62][CH2:63][O:64][CH2:65][CH3:66].[Cl-:47].[F:14][c:15]1[cH:16][c:17]([Mg+:18])[cH:19][c:20]([F:21])[c:22]1[F:23].[I:12].[Mg:11].[NH4+:48].[O:57]1[CH2:58][CH2:59][CH2:60][CH2:61]1.[OH2:56]>>[c:2]1([C:36]([CH2:35][O:34][CH2:33][CH:32]([NH:31][C:29]([O:28][C:24]([CH3:25])([CH3:26])[CH3:27])=[O:30])[CH2:38][O:39][CH2:40][c:41]2[cH:42][cH:43][cH:44][cH:45][cH:46]2)=[O:37])[cH:3][c:4]([F:10])[c:5]([F:9])[c:6]([F:8])[cH:7]1

Participants

13

Reactant 12

HCID 223AmmoniumHCID 259Bromide ionHCID 312ChlorideHCID 962WaterHCID 1140TolueneHCID 3283Diethyl EtherHCID 8028TetrahydrofuranHCID 24841Hydrogen iodideHCID 6114091-Bromo-3,4,5-trifluorobenzeneHCID 5462224MagnesiumHCID 67374936HCID 67374936, compoundHCID 178505947HCID 178505947, compound

Product 1

HCID 77274919HCID 77274919, compound

Sources & evidence

ORD record
ord-78db5a4634a54013bebfdfe2c3f2194e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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