Acetonitrile → HCID 11224536, compound

HRID 2151015Notes

Reaction equation

HRID 2151015 reaction equation
[CH3:29][C:30](=[O:31])[O:32][C:33](=[O:34])[CH3:35].[CH3:36][CH2:37][N:38]([CH2:39][CH3:40])[CH2:41][CH3:42].[CH3:43][C:44]#[N:45].[Cl:1][c:2]1[c:3](=[O:28])[n:4]([CH2:18][c:19]2[cH:20][c:21]3[cH:22][cH:23][nH:24][c:25]3[cH:26][cH:27]2)[cH:5][cH:6][c:7]1[O:8][CH2:9][c:10]1[c:11]([F:17])[cH:12][c:13]([F:16])[cH:14][cH:15]1>>[Cl:1][c:2]1[c:3](=[O:28])[n:4]([CH2:18][c:19]2[cH:20][c:21]3[cH:22][cH:23][n:24]([C:30]([CH3:29])=[O:31])[c:25]3[cH:26][cH:27]2)[cH:5][cH:6][c:7]1[O:8][CH2:9][c:10]1[c:11]([F:17])[cH:12][c:13]([F:16])[cH:14][cH:15]1

Participants

5

Reactant 4

HCID 6342AcetonitrileHCID 7918Acetic AnhydrideHCID 8471TriethylamineHCID 11234997HCID 11234997, compound

Product 1

HCID 11224536HCID 11224536, compound

Sources & evidence

ORD record
ord-85ebd2c1856a4890a59ffe2571c64437
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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