Hydrochloric Acid → HCID 10112859, compound

HRID 1540742Notes

Reaction equation

HRID 1540742 reaction equation
[CH2:36]1[O:37][CH2:38][CH2:39][CH2:40]1.[CH3:1][c:2]1[nH:3][c:4]2[cH:5][cH:6][c:7]([OH:18])[cH:8][c:9]2[c:10]1[CH:11]1[CH2:12][CH2:13][N:14]([CH3:17])[CH2:15][CH2:16]1.[CH3:32][C:33](=[O:34])[Cl:35].[CH3:44][CH2:45][OH:46].[ClH:31].[F:19][c:20]1[c:21]([S:27](=[O:28])(=[O:29])[Cl:30])[c:22]([F:26])[cH:23][cH:24][cH:25]1.[Na+:42].[OH-:41].[OH2:43]>>[CH3:1][c:2]1[nH:3][c:4]2[cH:5][cH:6][c:7]([O:18][S:27]([c:21]3[c:20]([F:19])[cH:25][cH:24][cH:23][c:22]3[F:26])(=[O:28])=[O:29])[cH:8][c:9]2[c:10]1[CH:11]1[CH2:12][CH2:13][N:14]([CH3:17])[CH2:15][CH2:16]1

Participants

10

Reactant 9

HCID 313Hydrochloric AcidHCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 6367Acetyl chlorideHCID 8028TetrahydrofuranHCID 27342712,6-Difluorobenzenesulfonyl chlorideHCID 17980111HCID 17980111, compound

Product 1

HCID 10112859HCID 10112859, compound

Sources & evidence

ORD record
ord-fa4ef77459694106a10df46e8c94e4f5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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