6-bromo-N,N-dimethylpyridazin-3-amine

• ChemBase ID: 308923
• Molecular Formular: C6H8BrN3
• Molecular Mass: 202.05182
• Monoisotopic Mass: 200.99015927
• SMILES: n1nc(ccc1N(C)C)Br
• Canonical SMILES: CN(c1ccc(nn1)Br)C
• InChI: InChI=1S/C6H8BrN3/c1-10(2)6-4-3-5(7)8-9-6/h3-4H,1-2H3
• InChIKey: UTWSRZIERMKJOJ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 6-bromo-N,N-dimethylpyridazin-3-amine
• IUPAC Traditional name: 6-bromo-N,N-dimethylpyridazin-3-amine
• Synonyms: 6-bromo-N,N-dimethyl-3-pyridazinamine

Database IDs

• CAS Number: 14959-33-2
• MDL Number: MFCD11223476

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 0
• LogD (pH = 5.5): 1.4522982
• LogD (pH = 7.4): 1.4525759
• Log P: 1.4525795
• Molar Refractivity: 46.9715 cm^3
• Polarizability: 16.32863 Å^3
• Polar Surface Area: 29.02 Å^2