6-(3-aminophenyl)pyridin-2-ol

• ChemBase ID: 290651
• Molecular Formular: C11H10N2O
• Molecular Mass: 186.2099
• Monoisotopic Mass: 186.07931295
• SMILES: Oc1nc(c2cccc(N)c2)ccc1
• Canonical SMILES: Nc1cccc(c1)c1cccc(n1)O
• InChI: InChI=1S/C11H10N2O/c12-9-4-1-3-8(7-9)10-5-2-6-11(14)13-10/h1-7H,12H2,(H,13,14)
• InChIKey: UAVKFUCNJPJKMI-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 6-(3-aminophenyl)pyridin-2-ol
• IUPAC Traditional name: 6-(3-aminophenyl)pyridin-2-ol
• Synonyms: 6-(3-Aminophenyl)pyridin-2-ol

Database IDs

• CAS Number: 161887-04-3
• PubChem SID: 180676182
• PubChem CID: 22009927

CALCULATED PROPERTIES

• Acid pKa: 11.668137
• H Acceptors: 3
• H Donor: 2
• LogD (pH = 5.5): 2.2434058
• LogD (pH = 7.4): 2.2505007
• Log P: 2.2506154
• Molar Refractivity: 55.6601 cm^3
• Polarizability: 22.165255 Å^3
• Polar Surface Area: 59.14 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 95+%