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

• ChemBase ID: 291035
• Molecular Formular: C6H6Br2N2
• Molecular Mass: 265.93324
• Monoisotopic Mass: 263.8897722
• SMILES: Nc1c(Br)cc(C)nc1Br
• Canonical SMILES: Cc1cc(Br)c(c(n1)Br)N
• InChI: InChI=1S/C6H6Br2N2/c1-3-2-4(7)5(9)6(8)10-3/h2H,9H2,1H3
• InChIKey: QIEYPRZZXMHRNU-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

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

Database IDs

• CAS Number: 706789-26-6
• PubChem SID: 180676566
• PubChem CID: 10084238

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): 1.8010185
• LogD (pH = 7.4): 1.8010446
• Log P: 1.8010448
• Molar Refractivity: 49.2808 cm^3
• Polarizability: 18.36143 Å^3
• Polar Surface Area: 38.91 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 95+%