Acetonitrile → HCID 59596848, compound

HRID 1127755Notes

Reaction equation

HRID 1127755 reaction equation
[CH3:25][CH2:26][N:27]([CH2:28][CH3:29])[CH2:30][CH3:31].[CH3:32][O:33][C:34]([CH2:35][Br:36])=[O:37].[CH3:38][C:39]#[N:40].[F:1][c:2]1[cH:3][c:4]([CH2:5][O:6][c:7]2[c:8]([O:20][CH3:21])[cH:9][c:10]([CH2:13][CH2:14][NH:15][CH2:16][CH:17]3[CH2:18][CH2:19]3)[cH:11][cH:12]2)[cH:22][cH:23][cH:24]1>>[F:1][c:2]1[cH:3][c:4]([CH2:5][O:6][c:7]2[c:8]([O:20][CH3:21])[cH:9][c:10]([CH2:13][CH2:14][N:15]([CH2:16][CH:17]3[CH2:18][CH2:19]3)[CH2:35][C:34]([O:33][CH3:32])=[O:37])[cH:11][cH:12]2)[cH:22][cH:23][cH:24]1

Participants

5

Reactant 4

HCID 6342AcetonitrileHCID 8471TriethylamineHCID 60984Methyl bromoacetateHCID 59596839HCID 59596839, compound

Product 1

HCID 59596848HCID 59596848, compound

Sources & evidence

ORD record
ord-e30c2d9a37cd48cb9044e242ed78a505
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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