Bicarbonate Ion → HCID 23081121, compound

HRID 665072Notes

Reaction equation

HRID 665072 reaction equation
[CH2:50]([Cl:51])[Cl:52].[CH3:1][C:2]1([CH2:13][N:14]2[CH2:15][CH2:16][N:17]([C:20](=[O:21])[O:22][CH2:23][c:24]3[cH:25][cH:26][c:27]([NH:30][C:31]([O:32][C:33]([CH3:34])([CH3:35])[CH3:36])=[O:37])[cH:28][cH:29]3)[CH2:18][CH2:19]2)[CH2:3][n:4]2[c:5]([n:7][c:8]([N+:10](=[O:11])[O-:12])[cH:9]2)[O:6]1.[Na+:45].[OH:38][C:39]([C:40]([F:41])([F:42])[F:43])=[O:44].[OH:46][C:47](=[O:48])[O-:49]>>[CH3:1][C:2]1([CH2:13][N:14]2[CH2:15][CH2:16][N:17]([C:20](=[O:21])[O:22][CH2:23][c:24]3[cH:25][cH:26][c:27]([NH2:30])[cH:28][cH:29]3)[CH2:18][CH2:19]2)[CH2:3][n:4]2[c:5]([n:7][c:8]([N+:10](=[O:11])[O-:12])[cH:9]2)[O:6]1

Participants

6

Reactant 5

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 69482361HCID 69482361, compound

Product 1

HCID 23081121HCID 23081121, compound

Sources & evidence

ORD record
ord-e542f1ea9c1a4333b32bfb96a779be13
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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