Acetonitrile → HCID 67131455, compound

HRID 134956Notes

Reaction equation

HRID 134956 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[CH2:9][CH:10]([CH2:21][O:22][c:23]2[cH:24][cH:25][c:26]([Cl:29])[cH:27][cH:28]2)[CH:11]([c:13]2[cH:14][c:15]([Cl:20])[c:16]([Cl:19])[cH:17][cH:18]2)[CH2:12]1.[CH3:39][C:40]#[N:41].[Cl:30][C:31]([O:32][CH2:33][C:34]([Cl:35])([Cl:36])[Cl:37])=[O:38]>>[NH:8]1[CH2:9][CH:10]([CH2:21][O:22][c:23]2[cH:24][cH:25][c:26]([Cl:29])[cH:27][cH:28]2)[CH:11]([c:13]2[cH:14][c:15]([Cl:20])[c:16]([Cl:19])[cH:17][cH:18]2)[CH2:12]1

Participants

4

Reactant 3

HCID 6342AcetonitrileHCID 870632,2,2-Trichloroethyl chloroformateHCID 67131589HCID 67131589, compound

Product 1

HCID 67131455HCID 67131455, compound

Sources & evidence

ORD record
ord-ed3afc638521466a987a0cb3ddb52cf6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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