imidazo[1,2-a]pyridin-2-amine

• ChemBase ID: 300201
• Molecular Formular: C7H7N3
• Molecular Mass: 133.15058
• Monoisotopic Mass: 133.06399724
• SMILES: c1ccn2cc(nc2c1)N
• Canonical SMILES: Nc1nc2n(c1)cccc2
• InChI: InChI=1S/C7H7N3/c8-6-5-10-4-2-1-3-7(10)9-6/h1-5H,8H2
• InChIKey: CQABHABFPKXGAF-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: imidazo[1,2-a]pyridin-2-amine
• IUPAC Traditional name: imidazo[1,2-a]pyridin-2-amine
• Synonyms: 2-Aminoimidazo[1,2-a]pyridine

Database IDs

• CAS Number: 28036-33-1
• MDL Number: MFCD06660421

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -0.6164649
• LogD (pH = 7.4): 0.4294144
• Log P: 0.525081
• Molar Refractivity: 40.9503 cm^3
• Polarizability: 14.424103 Å^3
• Polar Surface Area: 43.32 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 114-126°C

Safety Information

• European Hazard Symbols: X
• Risk Statements: 22
• Safety Statements: 36-60
• TSCA Listed: 否
• GHS Pictograms: GHS06
• GHS Hazard statements: H301
• GHS Precautionary statements: P264-P270-P301+P310-P321-P405-P501

Product Information

• Purity: 97%