Bicarbonate Ion → HCID 59714871, compound

HRID 1239856Notes

Reaction equation

HRID 1239856 reaction equation
[C:68](=[O:69])([OH:70])[O-:71].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[CH2:9][CH2:10][C:11]([CH2:14][CH2:15][O:16][Si:17]([C:18]([CH3:19])([CH3:20])[CH3:21])([c:22]2[cH:23][cH:24][cH:25][cH:26][cH:27]2)[c:28]2[cH:29][cH:30][cH:31][cH:32][cH:33]2)([CH2:34][CH2:35][N:36]2[CH2:37][CH2:38][CH:39]([N:42]([C:43](=[O:44])[c:45]3[o:46][cH:47][cH:48][cH:49]3)[c:50]3[cH:51][cH:52][c:53]([CH3:56])[cH:54][cH:55]3)[CH2:40][CH2:41]2)[CH2:12][CH2:13]1.[CH2:63]([NH3+:64])[CH2:65][CH2:66][CH3:67].[F-:62].[Na+:72].[O:57]1[CH2:58][CH2:59][CH2:60][CH2:61]1.[O:73]1[CH2:74][CH2:75][CH2:76][CH2:77]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[CH2:9][CH2:10][C:11]([CH2:14][CH2:15][OH:16])([CH2:34][CH2:35][N:36]2[CH2:37][CH2:38][CH:39]([N:42]([C:43](=[O:44])[c:45]3[o:46][cH:47][cH:48][cH:49]3)[c:50]3[cH:51][cH:52][c:53]([CH3:56])[cH:54][cH:55]3)[CH2:40][CH2:41]2)[CH2:12][CH2:13]1

Participants

7

Reactant 6

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 8028Tetrahydrofuran2×HCID 28179Fluoride IonHCID 3614750ButylammoniumHCID 59714968HCID 59714968, compound

Product 1

HCID 59714871HCID 59714871, compound

Sources & evidence

ORD record
ord-a6c803b27a7842198502baaf09dade2a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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