Hydrochloric Acid → HCID 19086758, compound

HRID 1112946Notes

Reaction equation

HRID 1112946 reaction equation
[C:15]1(=[O:22])[CH2:16][C:17](=[O:21])[CH2:18][CH2:19][CH2:20]1.[CH3:23][C:24]#[N:25].[CH3:26][C:27]([CH3:28])([OH:29])[C:30]#[N:31].[CH3:32][CH2:33][O:34][C:35](=[O:36])[CH3:37].[CH3:39][CH2:40][N:41]([CH2:42][CH3:43])[CH2:44][CH3:45].[Cl:1][c:2]1[c:3]([C:4](=[O:5])[Cl:6])[cH:7][cH:8][c:9]([O:11][CH:12]([F:13])[F:14])[cH:10]1.[ClH:38]>>[Cl:1][c:2]1[c:3]([C:4](=[O:5])[CH:16]2[C:15](=[O:22])[CH2:20][CH2:19][CH2:18][C:17]2=[O:21])[cH:7][cH:8][c:9]([O:11][CH:12]([F:13])[F:14])[cH:10]1

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 6342AcetonitrileHCID 6406Acetone CyanohydrinHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 104341,3-CyclohexanedioneHCID 19086757HCID 19086757, compound

Product 1

HCID 19086758HCID 19086758, compound

Sources & evidence

ORD record
ord-c34365ce68f54a498ca6593e07ae0998
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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