2,6-dibromo-4-methylpyridin-3-amine

• ChemBase ID: 290402
• Molecular Formular: C6H6Br2N2
• Molecular Mass: 265.93324
• Monoisotopic Mass: 263.8897722
• SMILES: Nc1c(C)cc(Br)nc1Br
• Canonical SMILES: Brc1cc(C)c(c(n1)Br)N
• InChI: InChI=1S/C6H6Br2N2/c1-3-2-4(7)10-6(8)5(3)9/h2H,9H2,1H3
• InChIKey: DZUAWLPRARGYAE-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2,6-dibromo-4-methylpyridin-3-amine
• IUPAC Traditional name: 2,6-dibromo-4-methylpyridin-3-amine
• Synonyms: 2,6-Dibromo-4-methylpyridin-3-amine

Database IDs

• CAS Number: 126354-83-4
• PubChem SID: 180675933
• PubChem CID: 14418048

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): 2.388618
• LogD (pH = 7.4): 2.388618
• Log P: 2.388618
• Molar Refractivity: 50.5727 cm^3
• Polarizability: 18.405468 Å^3
• Polar Surface Area: 38.91 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 95+%