Bicarbonate Ion → HCID 58896435, compound

HRID 302702Notes

Reaction equation

HRID 302702 reaction equation
[Br:32][CH2:33][C:34]#[N:35].[C:27](=[O:28])([OH:29])[O-:30].[C:36](=[O:37])([O-:38])[O-:39].[Cl:1][c:2]1[cH:3][cH:4][c:5]([NH:9][c:10]2[n:11][c:12]3[c:13]([n:14]2[CH3:15])[c:16]([N:20]([CH2:21][CH2:22][CH3:23])[CH2:24][CH2:25][CH3:26])[cH:17][cH:18][cH:19]3)[c:6]([OH:8])[cH:7]1.[Cs+:31].[K+:40].[K+:41].[O:42]1[CH2:43][CH2:44][CH2:45][CH2:46]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([NH:9][c:10]2[n:11][c:12]3[c:13]([n:14]2[CH3:15])[c:16]([N:20]([CH2:21][CH2:22][CH3:23])[CH2:24][CH2:25][CH3:26])[cH:17][cH:18][cH:19]3)[c:6]([O:8][CH2:33][C:34]#[N:35])[cH:7]1

Participants

8

Reactant 7

HCID 769Bicarbonate IonHCID 813Potassium Cation2×HCID 8028TetrahydrofuranHCID 11534BromoacetonitrileHCID 19660Carbonate IonHCID 104967Cesium cationHCID 58896585HCID 58896585, compound

Product 1

HCID 58896435HCID 58896435, compound

Sources & evidence

ORD record
ord-34bc0a75833847f4a9dbde6455c93b20
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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