Hydrochloric Acid → Hydrochloric Acid

HRID 191306Notes

Reaction equation

HRID 191306 reaction equation
[CH2:1]([CH3:2])[S:3](=[O:4])(=[O:5])[CH2:6][CH2:7][O:8][c:9]1[cH:10][c:11]([CH3:50])[c:12](-[c:16]2[c:17]3[c:21]([cH:22][cH:23][cH:24]2)[CH:20]([N:25]([c:26]2[cH:27][c:28]([F:37])[c:29]([CH2:32][CH2:33][C:34](=[O:35])[OH:36])[cH:30][cH:31]2)[S:38]([c:39]2[cH:40][cH:41][cH:42][cH:43][c:44]2[N+:45]([O-:46])=[O:47])(=[O:48])=[O:49])[CH2:19][CH2:18]3)[c:13]([CH3:15])[cH:14]1.[CH3:60][N:61]([CH3:62])[CH:63]=[O:64].[ClH:59].[Li+:58].[OH-:57].[OH2:56].[OH2:65].[SH:51][CH2:52][C:53]([OH:54])=[O:55]>>[CH2:1]([CH3:2])[S:3](=[O:4])(=[O:5])[CH2:6][CH2:7][O:8][c:9]1[cH:10][c:11]([CH3:50])[c:12](-[c:16]2[c:17]3[c:21]([cH:22][cH:23][cH:24]2)[CH:20]([NH:25][c:26]2[cH:27][c:28]([F:37])[c:29]([CH2:32][CH2:33][C:34](=[O:35])[OH:36])[cH:30][cH:31]2)[CH2:19][CH2:18]3)[c:13]([CH3:15])[cH:14]1.[ClH:59]

Participants

9

Reactant 7

HCID 313Hydrochloric AcidHCID 961HydroxideHCID 962Water2×HCID 1133Thioglycolic AcidHCID 6228DimethylformamideHCID 28486Lithium ionHCID 23157302HCID 23157302, compound

Product 2

HCID 313Hydrochloric AcidHCID 12002204HCID 12002204, compound

Sources & evidence

ORD record
ord-ca794255f8304d5f986f8cb633a06d9c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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