2,6-bis(benzyloxy)pyridin-4-amine

• ChemBase ID: 796656
• Molecular Formular: C19H18N2O2
• Molecular Mass: 306.35842
• Monoisotopic Mass: 306.13682783
• SMILES: n1c(cc(cc1OCc1ccccc1)N)OCc1ccccc1
• Canonical SMILES: Nc1cc(OCc2ccccc2)nc(c1)OCc1ccccc1
• InChI: InChI=1S/C19H18N2O2/c20-17-11-18(22-13-15-7-3-1-4-8-15)21-19(12-17)23-14-16-9-5-2-6-10-16/h1-12H,13-14H2,(H2,20,21)
• InChIKey: GISGCSSONLOCEI-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2,6-bis(benzyloxy)pyridin-4-amine
• IUPAC Traditional name: 2,6-bis(benzyloxy)pyridin-4-amine
• Synonyms: 2,6-Bis(benzyloxy)pyridin-4-aMine

Database IDs

• CAS Number: 23827-19-2

CALCULATED PROPERTIES

• H Acceptors: 4
• H Donor: 1
• LogD (pH = 5.5): 3.9633203
• LogD (pH = 7.4): 4.244056
• Log P: 4.249166
• Molar Refractivity: 91.3801 cm^3
• Polarizability: 34.800842 Å^3
• Polar Surface Area: 57.37 Å^2
• Rotatable Bonds: 6
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 97%