Bicarbonate Ion → HCID 21070036, compound

HRID 678241Notes

Reaction equation

HRID 678241 reaction equation
[CH3:41][C:42]([Cl:43])=[O:44].[CH:45]([N:46]([CH:47]([CH3:48])[CH3:49])[CH2:50][CH3:51])([CH3:52])[CH3:53].[F:1][c:2]1[cH:3][c:4]([N:33]2[CH:34]([CH2:39][OH:40])[CH2:35][CH2:36][C:37]2=[O:38])[c:5]([CH2:6][NH:7][C:8](=[O:9])[c:10]2[n:11][c:12]3[n:17]([c:18](=[O:28])[c:19]2[O:20][CH2:21][c:22]2[cH:23][cH:24][cH:25][cH:26][cH:27]2)[CH2:16][CH2:15][O:14][C:13]3([CH3:29])[CH3:30])[cH:31][cH:32]1.[Na+:58].[O-:54][C:55]([OH:56])=[O:57].[O:59]1[CH2:60][CH2:61][CH2:62][CH2:63]1>>[F:1][c:2]1[cH:3][c:4]([N:33]2[CH:34]([CH2:39][O:40][C:42]([CH3:41])=[O:44])[CH2:35][CH2:36][C:37]2=[O:38])[c:5]([CH2:6][NH:7][C:8](=[O:9])[c:10]2[n:11][c:12]3[n:17]([c:18](=[O:28])[c:19]2[O:20][CH2:21][c:22]2[cH:23][cH:24][cH:25][cH:26][cH:27]2)[CH2:16][CH2:15][O:14][C:13]3([CH3:29])[CH3:30])[cH:31][cH:32]1

Participants

7

Reactant 6

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 6367Acetyl chlorideHCID 8028TetrahydrofuranHCID 81531DiisopropylethylamineHCID 21070044HCID 21070044, compound

Product 1

HCID 21070036HCID 21070036, compound

Sources & evidence

ORD record
ord-e432bcb7c3e041e6b42004cbae00b54a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

Loading…