Bromide ion → HCID 20041061, compound

HRID 284090Notes

Reaction equation

HRID 284090 reaction equation
[BH4-:50].[Br-:7].[CH2:12]([Br:13])[CH3:14].[CH2:8]([Mg+:9])[CH3:10].[CH3:1][c:2]1[n:3][cH:4][s:5][cH:6]1.[CH3:53][c:54]1[cH:55][cH:56][cH:57][cH:58][cH:59]1.[Cl:15][c:16]1[cH:17][cH:18][c:19]([C:22]2([C:26]#[N:27])[CH2:23][CH2:24][CH2:25]2)[cH:20][cH:21]1.[Cl:31][c:32]1[cH:33][cH:34][c:35]([C:36]2([C:42](=[NH:43])[c:44]3[s:45][cH:46][c:47]([CH3:49])[n:48]3)[CH2:37][CH2:38][CH2:39]2)[cH:40][cH:41]1.[ClH:30].[Mg:11].[Na+:29].[Na+:51].[O:60]1[CH2:61][CH2:62][CH2:63][CH2:64]1.[OH-:28].[OH2:52]>>[Cl:15][c:16]1[cH:17][cH:18][c:19]([C:22]2([NH:43][CH2:42][c:44]3[s:45][cH:46][c:47]([CH3:49])[n:48]3)[CH2:23][CH2:24][CH2:25]2)[cH:20][cH:21]1

Participants

15

Reactant 14

HCID 259Bromide ionHCID 313Hydrochloric AcidHCID 923Sodium ion2×HCID 961HydroxideHCID 962WaterHCID 1140TolueneHCID 6332Ethyl BromideHCID 8028TetrahydrofuranHCID 127484-MethylthiazoleHCID 28123BorohydrideHCID 986211-(4-Chlorophenyl)cyclobutanecarbonitrileHCID 5462224MagnesiumHCID 20041057HCID 20041057, compoundHCID 178461628HCID 178461628, compound

Product 1

HCID 20041061HCID 20041061, compound

Sources & evidence

ORD record
ord-01183c65fdb14c6cbfce9f06086d5027
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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