Methanol → Methanesulfonic Acid

HRID 689388Notes

Reaction equation

HRID 689388 reaction equation
[CH3:1][S:2]([OH:3])(=[O:4])=[O:5].[CH3:35][OH:36].[CH:6]1([n:9]2[cH:10][c:11]([C:32](=[O:33])[OH:34])[c:12](=[O:31])[c:13]3[cH:14][c:15]([F:30])[c:16]([N:23]4[CH2:24][CH:25]([CH3:29])[NH:26][CH2:27][CH2:28]4)[c:17]([O:19][CH:20]([F:21])[F:22])[c:18]23)[CH2:7][CH2:8]1>>[CH3:1][S:2](=[O:3])(=[O:4])[OH:5].[CH:6]1([n:9]2[cH:10][c:11]([C:32](=[O:33])[OH:34])[c:12](=[O:31])[c:13]3[cH:14][c:15]([F:30])[c:16]([N:23]4[CH2:24][CH:25]([CH3:29])[NH:26][CH2:27][CH2:28]4)[c:17]([O:19][CH:20]([F:21])[F:22])[c:18]23)[CH2:7][CH2:8]1

Participants

5

Reactant 3

HCID 887MethanolHCID 6395Methanesulfonic AcidHCID 150237881-Cyclopropyl-8-difluoromethoxy-6-fluoro-7-(3-methylpiperazinyl)-1,4-dihydro-4-oxoquinoline-3-carboxylic acid

Product 2

HCID 6395Methanesulfonic AcidHCID 150237881-Cyclopropyl-8-difluoromethoxy-6-fluoro-7-(3-methylpiperazinyl)-1,4-dihydro-4-oxoquinoline-3-carboxylic acid

Sources & evidence

ORD record
ord-d1c4504b20ac42cb81f499bb78fd0d9d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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