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1-(2-Fluoro-4-nitrophenyl)-4-imidazolidinone

HCID 21026219
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
O=C1CN(c2ccc([N+](=O)[O-])cc2F)CN1
InChIKey
BHCRIUJVXHOCEX-UHFFFAOYSA-N
Molecular formula
C9H8FN3O3
Average molar mass
225.18 g/mol

Names & identifiers

Preferred name
1-(2-Fluoro-4-nitrophenyl)-4-imidazolidinone
IUPAC
1-(2-fluoro-4-nitrophenyl)imidazolidin-4-one

Names & synonyms

SCHEMBL5356318BHCRIUJVXHOCEX-UHFFFAOYSA-N1-(2-Fluoro-4-nitrophenyl)-4-imidazolidinone

Database identifiers

PubChem CID
21026219

Properties

Computed structural properties

XLogP
1.2
Topological polar surface area
78.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
1
Heavy atoms
16
Formal charge
0
Complexity
307

Related reactions

2 records
New reaction record
HRID 97327 reaction equation
HRID 97327As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 1373164 reaction equation
HRID 1373164As productuspto-grants-2007_01

Compound notes

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