Toluene → 1-(N-Pivaloyl-carbamoyl)-2-cyanoaziridine

HRID 1213869

Reaction equation

[C:1](#[N:2])[CH:3]1[NH:4][CH2:5]1.[CH3:13][C:14]([C:15](=[O:16])[N:17]=[C:18]=[O:19])([CH3:20])[CH3:21].[CH3:22][CH2:23][O:24][CH2:25][CH3:26].[CH3:6][c:7]1[cH:8][cH:9][cH:10][cH:11][cH:12]1>>[C:1](#[N:2])[CH:3]1[N:4]([C:18]([NH:17][C:15]([C:14]([CH3:13])([CH3:20])[CH3:21])=[O:16])=[O:19])[CH2:5]1

Participants

Reactant 4

HCID 1140Toluene

HCID 3283Diethyl Ether

HCID 118115Aziridine-2-carbonitrile

HCID 126188362,2-dimethylpropanecarbonyl isocyanate

Product 1

HCID 211619901-(N-Pivaloyl-carbamoyl)-2-cyanoaziridine

Sources & evidence

ORD record: ord-2909e85dd2e94daf935ed8436127e455
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

Linked notes

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