Acetonitrile → HCID 69460308, compound

HRID 2137049Notes

Reaction equation

HRID 2137049 reaction equation
[CH3:1][O:2][C:3]([C:4]([CH3:5])([CH3:6])[O:7][c:8]1[c:9]([Cl:16])[cH:10][c:11]([OH:15])[c:12]([Cl:14])[cH:13]1)=[O:17].[CH3:39][C:40]#[N:41].[F:18][C:19]([O:20][c:21]1[cH:22][cH:23][c:24]([C:27]#[C:28][CH2:29][CH2:30][CH2:31][O:32][S:33]([CH3:34])(=[O:35])=[O:36])[cH:25][cH:26]1)([F:37])[F:38]>>[CH3:1][O:2][C:3]([C:4]([CH3:5])([CH3:6])[O:7][c:8]1[c:9]([Cl:16])[cH:10][c:11]([O:15][CH2:31][CH2:30][CH2:29][C:28]#[C:27][c:24]2[cH:23][cH:22][c:21]([O:20][C:19]([F:18])([F:37])[F:38])[cH:26][cH:25]2)[c:12]([Cl:14])[cH:13]1)=[O:17]

Participants

4

Reactant 3

HCID 6342AcetonitrileHCID 11616756Methanesulfonic acid 5-(4-trifluoromethoxy-phenyl)-pent-4-ynyl esterHCID 67402766HCID 67402766, compound

Product 1

HCID 69460308HCID 69460308, compound

Sources & evidence

ORD record
ord-e96159ab88334e859e883420b401f458
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

Loading…