Hydrochloric Acid → HCID 11505106, compound

HRID 293458Notes

Reaction equation

HRID 293458 reaction equation
[CH2:49]1[O:50][CH2:51][CH2:52][CH2:53]1.[CH3:1][O:2][C:3]([CH2:4][O:5][c:6]1[c:7]2[c:11]([c:12]([S:15][c:16]3[cH:17][c:18]([C:31]#[C:32][c:33]4[cH:34][cH:35][c:36]([Cl:39])[cH:37][cH:38]4)[n:19][c:20]([C:22]#[C:23][c:24]4[cH:25][cH:26][c:27]([Cl:30])[cH:28][cH:29]4)[cH:21]3)[cH:13][cH:14]1)[CH2:10][CH2:9][CH2:8]2)=[O:40].[CH3:43][CH2:44][O:45][C:46](=[O:47])[CH3:48].[CH3:54][CH2:55][OH:56].[ClH:41].[Na+:58].[OH-:57].[OH2:42]>>[O:2]=[C:3]([CH2:4][O:5][c:6]1[c:7]2[c:11]([c:12]([S:15][c:16]3[cH:17][c:18]([C:31]#[C:32][c:33]4[cH:34][cH:35][c:36]([Cl:39])[cH:37][cH:38]4)[n:19][c:20]([C:22]#[C:23][c:24]4[cH:25][cH:26][c:27]([Cl:30])[cH:28][cH:29]4)[cH:21]3)[cH:13][cH:14]1)[CH2:10][CH2:9][CH2:8]2)[OH:40]

Participants

9

Reactant 8

HCID 313Hydrochloric AcidHCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 67266547HCID 67266547, compound

Product 1

HCID 11505106HCID 11505106, compound

Sources & evidence

ORD record
ord-fcaadde094f748ce86c0c8a21be43f04
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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