1-Hexyl-4-methyl-3-nitro-5-phenyl-2-pyridone

HCID 21706540
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Basic information

Standard SMILES
CCCCCCn1cc(-c2ccccc2)c(C)c([N+](=O)[O-])c1=O
InChIKey
VIGJNEFZFLLQRL-UHFFFAOYSA-N
Molecular formula
C18H22N2O3
Average molar mass
314.4 g/mol
Monoisotopic mass
314.16304257

Names & identifiers

Preferred name
1-Hexyl-4-methyl-3-nitro-5-phenyl-2-pyridone
IUPAC
1-hexyl-4-methyl-3-nitro-5-phenylpyridin-2-one

Names & synonyms

SCHEMBL4679893VIGJNEFZFLLQRL-UHFFFAOYSA-N1-hexyl-4-methyl-3-nitro-5-phenyl-2-pyridone

Database identifiers

PubChem CID
21706540

Properties

Computed structural properties

XLogP
3.9
Topological polar surface area
66.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
6
Heavy atoms
23

Related reactions

6 records
New reaction record

Compound notes

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