Trimethylamine → Methanesulfonic Acid

HRID 2140556Notes

Reaction equation

HRID 2140556 reaction equation
[CH3:1][S:2](=[O:3])(=[O:4])[OH:5].[CH3:39][N:40]=[C:41]=[O:42].[CH3:43][N:44]([CH3:45])[CH3:46].[CH:47]([Cl:48])([Cl:49])[Cl:50].[OH:6][CH:7]([CH2:8][S:9](=[O:10])(=[O:11])[CH2:12][CH2:13][CH2:14][N+:15]([CH3:16])([CH3:17])[CH3:18])[CH2:19][O:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH3:38]>>[CH3:1][S:2](=[O:3])(=[O:4])[OH:5].[O:6]([CH:7]([CH2:8][S:9](=[O:10])(=[O:11])[CH2:12][CH2:13][CH2:14][N+:15]([CH3:16])([CH3:17])[CH3:18])[CH2:19][O:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH3:38])[C:41]([NH:40][CH3:39])=[O:42]

Participants

7

Reactant 5

HCID 1146TrimethylamineHCID 6212ChloroformHCID 6395Methanesulfonic AcidHCID 12228Methyl IsocyanateHCID 14498243HCID 14498243, compound

Product 2

HCID 6395Methanesulfonic AcidHCID 14498245HCID 14498245, compound

Sources & evidence

ORD record
ord-6dd49a8649c847cfa7ef52a64e7cf833
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

Loading…