6-bromo-4-methylpyridin-2-amine

• ChemBase ID: 287668
• Molecular Formular: C6H7BrN2
• Molecular Mass: 187.03718
• Monoisotopic Mass: 185.97926023
• SMILES: Cc1cc(Br)nc(N)c1
• Canonical SMILES: Cc1cc(N)nc(c1)Br
• InChI: InChI=1S/C6H7BrN2/c1-4-2-5(7)9-6(8)3-4/h2-3H,1H3,(H2,8,9)
• InChIKey: ABYCTYJDRLQBMT-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 6-bromo-4-methylpyridin-2-amine
• IUPAC Traditional name: 6-bromo-4-methylpyridin-2-amine
• Synonyms: 6-Bromo-4-methylpyridin-2-amine

Database IDs

• CAS Number: 73895-98-4
• PubChem SID: 180673199
• PubChem CID: 22176507

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): 1.9939018
• LogD (pH = 7.4): 2.0086102
• Log P: 2.008801
• Molar Refractivity: 42.4212 cm^3
• Polarizability: 15.2429285 Å^3
• Polar Surface Area: 38.91 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 95+%; 98%