Bromide ion → HCID 68808158, compound

HRID 107118Notes

Reaction equation

HRID 107118 reaction equation
[BH:23]([OH:24])[OH:25].[Br-:40].[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH:9]([C:13]([NH:14][c:15]2[cH:16][cH:17][c:18]([Br:21])[cH:19][cH:20]2)=[O:22])[CH2:10][CH2:11][CH2:12]1.[C:34](=[O:35])([O-:36])[O-:37].[CH3:26][S:27][c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1.[CH3:41][CH2:42][CH2:43][CH2:44][N+:45]([CH2:46][CH2:47][CH2:48][CH3:49])([CH2:50][CH2:51][CH2:52][CH3:53])[CH2:54][CH2:55][CH2:56][CH3:57].[CH3:58][c:59]1[cH:60][cH:61][cH:62][cH:63][cH:64]1.[Na+:38].[Na+:39]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH:9]([C:13]([NH:14][c:15]2[cH:16][cH:17][c:18](-[c:29]3[c:28]([S:27][CH3:26])[cH:33][cH:32][cH:31][cH:30]3)[cH:19][cH:20]2)=[O:22])[CH2:10][CH2:11][CH2:12]1

Participants

9

Reactant 8

HCID 259Bromide ionHCID 923Sodium ion2×HCID 1140TolueneHCID 7520ThioanisoleHCID 16028TetrabutylammoniumHCID 19660Carbonate IonHCID 61668Boronic AcidHCID 551020HCID 551020, compound

Product 1

HCID 68808158HCID 68808158, compound

Sources & evidence

ORD record
ord-3c4a6cc623df48579eed479be0dce130
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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