Bromide ion → HCID 178468784, compound

HRID 1219938Notes

Reaction equation

HRID 1219938 reaction equation
[B:30]([F:31])([F:32])[F:33].[Br-:21].[CH2:22]([CH3:23])[Mg+:24].[CH2:25]([O:26][CH2:27][CH3:28])[CH3:29].[CH2:36]([O:37][CH2:38][CH3:39])[CH3:40].[CH3:41][CH:42]([CH3:43])[O-:44].[CH3:45][CH:46]([CH3:47])[O-:48].[CH3:49][CH:50]([CH3:51])[O-:52].[CH3:53][CH:54]([CH3:55])[O-:56].[Cl:1][c:2]1[c:3]([CH:10]([CH3:11])[O:12][C:13]([c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)=[O:20])[cH:4][cH:5][c:6]([C:8]#[N:9])[cH:7]1.[Na+:35].[OH-:34].[Ti+4:57]>>[Cl:1][c:2]1[c:3]([CH:10]([CH3:11])[O:12][C:13]([c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)=[O:20])[cH:4][cH:5][c:6]([C:8]2([NH2:9])[CH2:22][CH2:23]2)[cH:7]1

Participants

10

Reactant 9

HCID 259Bromide ionHCID 923Sodium ionHCID 961HydroxideHCID 3283Diethyl Ether2×HCID 6356Boron trifluorideHCID 114942Titanium cation (4+)HCID 3260420Isopropanolate4×HCID 178461628HCID 178461628, compoundHCID 178468785HCID 178468785, compound

Product 1

HCID 178468784HCID 178468784, compound

Sources & evidence

ORD record
ord-f966552e85e44db7af91a1400f2671f8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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