Methanesulfonic Acid → Methanesulfonic Acid

HRID 1550485Notes

Reaction equation

HRID 1550485 reaction equation
[CH3:1][S:2](=[O:3])(=[O:4])[CH2:5][C:6](=[O:7])[NH:8][CH2:9][CH2:10][n:11]1[cH:12][cH:13][c:14]2[n:15][cH:16][n:17][c:18]([NH:20][c:21]3[cH:22][c:23]([CH3:38])[c:24]([O:27][c:28]4[cH:29][c:30]([C:34]([F:35])([F:36])[F:37])[cH:31][cH:32][cH:33]4)[cH:25][cH:26]3)[c:19]12.[CH3:39][S:40]([OH:41])(=[O:42])=[O:43].[CH3:44][CH2:45][O:46][C:47](=[O:48])[CH3:49]>>[CH3:1][S:2](=[O:3])(=[O:4])[CH2:5][C:6](=[O:7])[NH:8][CH2:9][CH2:10][n:11]1[cH:12][cH:13][c:14]2[n:15][cH:16][n:17][c:18]([NH:20][c:21]3[cH:22][c:23]([CH3:38])[c:24]([O:27][c:28]4[cH:29][c:30]([C:34]([F:35])([F:36])[F:37])[cH:31][cH:32][cH:33]4)[cH:25][cH:26]3)[c:19]12.[CH3:39][S:40](=[O:41])(=[O:42])[OH:43]

Participants

5

Reactant 3

HCID 6395Methanesulfonic AcidHCID 8857Ethyl AcetateHCID 57597214HCID 57597214, compound

Product 2

HCID 6395Methanesulfonic AcidHCID 57597214HCID 57597214, compound

Sources & evidence

ORD record
ord-7d80d5c4272249d8956f5bceb915da26
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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