6-bromoimidazo[1,2-a]pyridin-2-amine

• ChemBase ID: 87508
• Molecular Formular: C7H6BrN3
• Molecular Mass: 212.04664
• Monoisotopic Mass: 210.97450921
• SMILES: n12cc(ccc1nc(c2)N)Br
• Canonical SMILES: Brc1ccc2n(c1)cc(n2)N
• InChI: InChI=1S/C7H6BrN3/c8-5-1-2-7-10-6(9)4-11(7)3-5/h1-4H,9H2
• InChIKey: LAUJNLOJYLUKCP-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 6-bromoimidazo[1,2-a]pyridin-2-amine
• IUPAC Traditional name: 6-bromoimidazo[1,2-a]pyridin-2-amine
• Synonyms: 6-Bromoimidazo[1,2-a]pyridin-2-amine; 2-Amino-6-bromoimidazo[1,2-a]pyridine

Database IDs

• CAS Number: 947248-52-4
• MDL Number: MFCD09864902
• PubChem SID: 162074548
• PubChem CID: 44119296

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): 0.18563277
• LogD (pH = 7.4): 1.2082835
• Log P: 1.2938336
• Molar Refractivity: 48.5731 cm^3
• Polarizability: 17.301132 Å^3
• Polar Surface Area: 43.32 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• Storage Warning: Harmful/Irritant/Light Sensitive/Keep Cold