3-fluoropiperidine

• ChemBase ID: 281934
• Molecular Formular: C5H10FN
• Molecular Mass: 103.1380032
• Monoisotopic Mass: 103.07972755
• SMILES: N1CC(F)CCC1
• Canonical SMILES: FC1CCCNC1
• InChI: InChI=1S/C5H10FN/c6-5-2-1-3-7-4-5/h5,7H,1-4H2
• InChIKey: YUKQZLBLVRAJSW-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 3-fluoropiperidine
• IUPAC Traditional name: 3-fluoropiperidine
• Synonyms: 3-fluoropiperidine

Database IDs

• MDL Number: MFCD03093850
• PubChem SID: 180667465
• PubChem CID: 2759157

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): -2.4868202
• LogD (pH = 7.4): -0.9195281
• Log P: 0.47367582
• Molar Refractivity: 26.5048 cm^3
• Polarizability: 10.443085 Å^3
• Polar Surface Area: 12.03 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 0.778

Product Information

• Purity: 95%