Bicarbonate Ion → HCID 10163712, compound

HRID 1555945Notes

Reaction equation

HRID 1555945 reaction equation
[CH2:3]([c:4]1[cH:5][cH:6][cH:7][cH:8][cH:9]1)[N:10]1[CH:11]([c:17]2[cH:18][cH:19][cH:20][cH:21][cH:22]2)[CH:12]([OH:16])[O:13][CH2:14][CH2:15]1.[CH2:44]1[O:45][CH2:46][CH2:47][CH2:48]1.[CH2:50]([N+:51]([CH2:52][CH2:53][CH2:54][CH3:55])([CH2:56][CH2:57][CH2:58][CH3:59])[CH2:60][CH2:61][CH2:62][CH3:63])[CH2:64][CH2:65][CH3:66].[F:23][C:24]([c:25]1[cH:26][c:27]([CH2:28][Br:29])[cH:30][c:31]([C:33]([F:34])([F:35])[F:36])[cH:32]1)([F:37])[F:38].[H-:2].[I-:49].[Na+:1].[Na+:43].[O-:39][C:40]([OH:41])=[O:42]>>[CH2:3]([c:4]1[cH:5][cH:6][cH:7][cH:8][cH:9]1)[N:10]1[CH:11]([c:17]2[cH:18][cH:19][cH:20][cH:21][cH:22]2)[CH:12]([O:16][CH2:28][c:27]2[cH:26][c:25]([C:24]([F:23])([F:37])[F:38])[cH:32][c:31]([C:33]([F:34])([F:35])[F:36])[cH:30]2)[O:13][CH2:14][CH2:15]1

Participants

9

Reactant 8

HCID 769Bicarbonate IonHCID 923Sodium ion2×HCID 8028TetrahydrofuranHCID 16028TetrabutylammoniumHCID 30165Iodide IonHCID 1225733,5-Bis(trifluoromethyl)benzyl bromideHCID 166653HydrideHCID 15501116HCID 15501116, compound

Product 1

HCID 10163712HCID 10163712, compound

Sources & evidence

ORD record
ord-178ff566b3ab424f8c92f97bb5a249b3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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