Hydrochloric Acid → HCID 58531394, compound

HRID 1218618Notes

Reaction equation

HRID 1218618 reaction equation
[CH3:39][S:40]([Cl:41])(=[O:42])=[O:43].[CH3:44][CH2:45][N:46]([CH2:47][CH3:48])[CH2:49][CH3:50].[CH3:52][CH2:53][O:54][C:55]([CH3:56])=[O:57].[Cl:1][c:2]1[c:3]([OH:38])[c:4]([S:9](=[O:10])(=[O:11])[N:12]([CH2:13][c:14]2[cH:15][c:16]([O:22][c:23]3[cH:24][cH:25][c:26]([F:29])[cH:27][cH:28]3)[cH:17][c:18]([CH2:20][OH:21])[cH:19]2)[CH2:30][c:31]2[cH:32][cH:33][c:34]([F:37])[cH:35][cH:36]2)[cH:5][c:6]([Cl:8])[cH:7]1.[ClH:51]>>[Cl:1][c:2]1[c:3]([OH:38])[c:4]([S:9](=[O:10])(=[O:11])[N:12]([CH2:13][c:14]2[cH:15][c:16]([O:22][c:23]3[cH:24][cH:25][c:26]([F:29])[cH:27][cH:28]3)[cH:17][c:18]([CH2:20][O:21][S:40]([CH3:39])(=[O:42])=[O:43])[cH:19]2)[CH2:30][c:31]2[cH:32][cH:33][c:34]([F:37])[cH:35][cH:36]2)[cH:5][c:6]([Cl:8])[cH:7]1

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 31297Methanesulfonyl chlorideHCID 58531487HCID 58531487, compound

Product 1

HCID 58531394HCID 58531394, compound

Sources & evidence

ORD record
ord-8b5b704c802b432ca6a92954e9aeafd9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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