2,5-Difluoronitrobenzene → 3-(4-Fluoro-2-nitrophenoxy)-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid

HRID 667176

Reaction equation

HRID 667176 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH:9]([C:10](=[O:11])[OH:12])[CH:13]([CH3:14])[OH:15].[F:16][c:17]1[c:18]([N+:24](=[O:25])[O-:26])[cH:19][c:20]([F:23])[cH:21][cH:22]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH:9]([C:10](=[O:11])[OH:12])[CH:13]([CH3:14])[O:15][c:17]1[c:18]([N+:24](=[O:25])[O-:26])[cH:19][c:20]([F:23])[cH:21][cH:22]1

Participants

3

Reactant 2

HCID 677672,5-DifluoronitrobenzeneHCID 100116N-(tert-butyloxycarbonyl)-L-threonine

Product 1

HCID 199616823-(4-Fluoro-2-nitrophenoxy)-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid

Sources & evidence

ORD record
ord-20ae43d720c941cd88a1b611b70bd860
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Linked notes

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