Bicarbonate Ion → HCID 178499463, compound

HRID 197067Notes

Reaction equation

HRID 197067 reaction equation
[CH3:54][CH2:55][O:56][C:57](=[O:58])[CH3:59].[Cl:1][c:2]1[cH:3][c:4]([CH2:39][C:40](=[O:41])[O:42][CH3:43])[cH:5][cH:6][c:7]1[O:8][c:9]1[cH:10][c:11]2[c:12]([n:13][c:14]([CH3:24])[n:15]2[CH2:16][O:17][CH2:18][CH2:19][Si:20]([CH3:21])([CH3:22])[CH3:23])[cH:25][c:26]1[NH:27][S:28](=[O:29])(=[O:30])[c:31]1[c:32]([Cl:38])[cH:33][c:34]([Cl:37])[cH:35][cH:36]1.[Cl:51][CH2:52][Cl:53].[Na+:64].[O-:60][C:61]([OH:62])=[O:63].[OH:44][C:45]([C:46]([F:47])([F:48])[F:49])=[O:50]>>[Cl:1][c:2]1[cH:3][c:4]([CH2:39][C:40](=[O:41])[O:42][CH3:43])[cH:5][cH:6][c:7]1[O:8][c:9]1[cH:10][c:11]2[c:12]([n:13][c:14]([CH3:24])[nH:15]2)[cH:25][c:26]1[NH:27][S:28](=[O:29])(=[O:30])[c:31]1[c:32]([Cl:38])[cH:33][c:34]([Cl:37])[cH:35][cH:36]1

Participants

7

Reactant 6

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 8857Ethyl AcetateHCID 59864823HCID 59864823, compound

Product 1

HCID 178499463HCID 178499463, compound

Sources & evidence

ORD record
ord-adf2750414c04853ab3c50388efe31b4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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