2-Butenedioic acid → 2-Butenedioic acid

HRID 141579Notes

Reaction equation

HRID 141579 reaction equation
[C:30]([CH:31]=[CH:32][C:33](=[O:34])[O-:35])(=[O:36])[O-:37].[CH3:46][CH2:47][O:48][CH2:49][CH3:50].[CH:1]1([N:13]2[CH2:14][CH2:15][C:16]3([CH:17]([OH:27])[CH2:18][CH2:19][N:20]3[c:21]3[cH:22][cH:23][cH:24][cH:25][cH:26]3)[CH2:28][CH2:29]2)[CH2:2][c:3]2[cH:4][cH:5][cH:6][c:7]3[cH:8][cH:9][cH:10][c:11]1[c:12]23.[OH:38][C:39]([CH:40]=[CH:41][C:42](=[O:43])[OH:44])=[O:45]>>[C:30]([CH:31]=[CH:32][C:33](=[O:34])[OH:35])(=[O:36])[OH:37].[CH:1]1([N:13]2[CH2:14][CH2:15][C:16]3([CH:17]([O:27][CH3:39])[CH2:18][CH2:19][N:20]3[c:21]3[cH:22][cH:23][cH:24][cH:25][cH:26]3)[CH2:28][CH2:29]2)[CH2:2][c:3]2[cH:4][cH:5][cH:6][c:7]3[cH:8][cH:9][cH:10][c:11]1[c:12]23

Participants

6

Reactant 4

HCID 7232-Butenedioic acidHCID 3283Diethyl EtherHCID 164547ButenedioateHCID 15411837HCID 15411837, compound

Product 2

HCID 7232-Butenedioic acidHCID 18002530HCID 18002530, compound

Sources & evidence

ORD record
ord-2ee65a71cd0d43a597c5ba414974dcab
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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