4-fluoropiperidine

• ChemBase ID: 813260
• Molecular Formular: C5H10FN
• Molecular Mass: 103.1380032
• Monoisotopic Mass: 103.07972755
• SMILES: C1(CCNCC1)F
• Canonical SMILES: FC1CCNCC1
• InChI: InChI=1S/C5H10FN/c6-5-1-3-7-4-2-5/h5,7H,1-4H2
• InChIKey: QBLLOOKBLTTXHB-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 4-fluoropiperidine
• IUPAC Traditional name: 4-fluoropiperidine
• Synonyms: 4-FLUOROPIPERIDINE

Database IDs

• CAS Number: 78197-27-0

CALCULATED PROPERTIES

• LogD (pH = 7.4): -2.361211
• Log P: 0.016272895
• Molar Refractivity: 26.7256 cm^3
• Polarizability: 10.442967 Å^3
• Polar Surface Area: 12.03 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true
• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): -3.192383

PROPERTIES

Product Information

• Purity: 98%