4-Cyclobutyl-2-fluoroaniline

HCID 59565186

Notes Reactions

Substructure search Find similar structures

Basic information

Standard SMILES: Nc1ccc(C2CCC2)cc1F
InChIKey: UPVQJAUHZOXUAS-UHFFFAOYSA-N
Molecular formula: C10H12FN
Average molar mass: 165.21 g/mol
Monoisotopic mass: 165.09537755

Names & identifiers

Preferred name: 4-Cyclobutyl-2-fluoroaniline
IUPAC: 4-cyclobutyl-2-fluoroaniline

Names & synonyms

4-cyclobutyl-2-fluoroaniline1168102-59-74-cyclobutyl-2-fluoro-anilineSCHEMBL19715754-Cyclobutyl-2-fluorobenzenamineUPVQJAUHZOXUAS-UHFFFAOYSA-NAKOS040767777AT45895DB-381114

Database identifiers

PubChem CID: 59565186

Properties

Computed structural properties

XLogP: 2.8
Topological polar surface area: 26 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 1
Heavy atoms: 12
Formal charge: 0
Complexity: 156

Related reactions

4 records

New reaction record

HRID 289847As productTraining data from https://doi.org/10.1039/C8SC04228D (8/10)

HRID 2067030As productuspto-grants-2012_10

HRID 2067031As reactantuspto-grants-2012_10

HRID 2160593As reactantTraining data from https://doi.org/10.1039/C8SC04228D (4/10)

Compound notes

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