Bicarbonate Ion → Oxalic Acid

HRID 1221393Notes

Reaction equation

HRID 1221393 reaction equation
[Br:18][CH2:19][CH2:20][CH2:21][c:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1.[C:33]([C:34](=[O:35])[O-:36])(=[O:37])[O-:38].[CH3:1][NH:2][CH2:3][CH2:4][C:5]12[O:6][c:7]3[c:8]([cH:14][cH:15][cH:16][cH:17]3)[CH:9]1[CH2:10][CH2:11][CH2:12][CH2:13]2.[Na+:32].[O-:28][C:29]([OH:30])=[O:31].[O:39]=[CH:40][N:41]([CH3:42])[CH3:43]>>[C:33]([C:34](=[O:35])[OH:36])(=[O:37])[OH:38].[CH3:1][N:2]([CH2:3][CH2:4][C:5]12[O:6][c:7]3[c:8]([cH:14][cH:15][cH:16][cH:17]3)[CH:9]1[CH2:10][CH2:11][CH2:12][CH2:13]2)[CH2:19][CH2:20][CH2:21][c:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1

Participants

8

Reactant 6

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 6228DimethylformamideHCID 12503(3-Bromopropyl)benzeneHCID 71081OxalateHCID 13882289HCID 13882289, compound

Product 2

HCID 971Oxalic AcidHCID 13882298HCID 13882298, compound

Sources & evidence

ORD record
ord-eafbeed62b3b4b39b33888425fc8df03
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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