Methanol → HCID 21868899, compound

HRID 682795Notes

Reaction equation

HRID 682795 reaction equation
[CH3:57][OH:58].[O:45]1[CH2:46][CH2:47][CH2:48][CH2:49]1.[OH2:50].[OH:51][C:52]([C:53](=[O:54])[OH:55])=[O:56].[c:1]1([C:7]2=[C:8]([c:25]3[cH:26][cH:27][c:28]([O:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][S:35][CH2:36][CH2:37][CH2:38][C:39]([F:40])([F:41])[F:42])[cH:43][cH:44]3)[c:9]3[c:10]([cH:14][c:15]([O:18][CH:19]4[CH2:20][CH2:21][CH2:22][CH2:23][O:24]4)[cH:16][cH:17]3)[CH2:11][CH2:12][CH2:13]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([C:7]2=[C:8]([c:25]3[cH:26][cH:27][c:28]([O:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][S:35][CH2:36][CH2:37][CH2:38][C:39]([F:40])([F:41])[F:42])[cH:43][cH:44]3)[c:9]3[c:10]([cH:14][c:15]([OH:18])[cH:16][cH:17]3)[CH2:11][CH2:12][CH2:13]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

6

Reactant 5

HCID 887MethanolHCID 962WaterHCID 971Oxalic AcidHCID 8028TetrahydrofuranHCID 69589545HCID 69589545, compound

Product 1

HCID 21868899HCID 21868899, compound

Sources & evidence

ORD record
ord-9371f512d9e442e89734ffb1d04b40ab
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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