Acetonitrile → HCID 9934727, compound

HRID 689271Notes

Reaction equation

HRID 689271 reaction equation
[Br:38][CH2:39][C:40](=[O:41])[O:42][CH3:43].[CH3:44][C:45]#[N:46].[CH:29]([N:30]([CH2:31][CH3:32])[CH:33]([CH3:34])[CH3:35])([CH3:36])[CH3:37].[F:1][C:2]([c:3]1[cH:4][c:5]([CH2:6][O:7][CH:8]2[O:9][CH2:10][CH2:11][NH:12][CH:13]2[c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[cH:20][c:21]([C:23]([F:24])([F:25])[F:26])[cH:22]1)([F:27])[F:28]>>[F:1][C:2]([c:3]1[cH:4][c:5]([CH2:6][O:7][CH:8]2[O:9][CH2:10][CH2:11][N:12]([CH2:39][C:40](=[O:41])[O:42][CH3:43])[CH:13]2[c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[cH:20][c:21]([C:23]([F:24])([F:25])[F:26])[cH:22]1)([F:27])[F:28]

Participants

5

Reactant 4

HCID 6342AcetonitrileHCID 60984Methyl bromoacetateHCID 81531DiisopropylethylamineHCID 9801388HCID 9801388, compound

Product 1

HCID 9934727HCID 9934727, compound

Sources & evidence

ORD record
ord-efeaca381aa549d0ad70c8e67987946f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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