5-(4-fluorophenoxy)pyridin-2-amine

• ChemBase ID: 270575
• Molecular Formular: C11H9FN2O
• Molecular Mass: 204.2003632
• Monoisotopic Mass: 204.06989114
• SMILES: n1c(N)ccc(Oc2ccc(F)cc2)c1
• Canonical SMILES: Fc1ccc(cc1)Oc1ccc(nc1)N
• InChI: InChI=1S/C11H9FN2O/c12-8-1-3-9(4-2-8)15-10-5-6-11(13)14-7-10/h1-7H,(H2,13,14)
• InChIKey: GJYQBDCLIHYVSB-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 5-(4-fluorophenoxy)pyridin-2-amine
• IUPAC Traditional name: 5-(4-fluorophenoxy)pyridin-2-amine
• Synonyms: 5-(4-fluorophenoxy)pyridin-2-amine

Database IDs

• MDL Number: MFCD11135786
• PubChem SID: 164326485
• PubChem CID: 28412165

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): 1.6108298
• LogD (pH = 7.4): 2.1489756
• Log P: 2.164094
• Molar Refractivity: 55.3722 cm^3
• Polarizability: 20.565495 Å^3
• Polar Surface Area: 48.14 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 74 - 76°C
• Hydrophobicity(logP): 2.559

Product Information

• Purity: 95%