imidazo[1,2-a]pyridin-6-ylmethanol hydrochloride

• ChemBase ID: 293383
• Molecular Formular: C8H9ClN2O
• Molecular Mass: 184.62286
• Monoisotopic Mass: 184.0403406
• SMILES: OCc1cn2c(cc1)ncc2.Cl
• Canonical SMILES: OCc1ccc2n(c1)ccn2.Cl
• InChI: InChI=1S/C8H8N2O.ClH/c11-6-7-1-2-8-9-3-4-10(8)5-7;/h1-5,11H,6H2;1H
• InChIKey: BMAAYSMVYXIDTI-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: imidazo[1,2-a]pyridin-6-ylmethanol hydrochloride
• IUPAC Traditional name: imidazo[1,2-a]pyridin-6-ylmethanol hydrochloride
• Synonyms: Imidazo[1,2-a]pyridin-6-ylmethanol hydrochloride

Database IDs

• PubChem SID: 180678914
• PubChem CID: 71748611

CALCULATED PROPERTIES

• Acid pKa: 14.859896
• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -0.8171328
• LogD (pH = 7.4): -0.063106276
• Log P: -0.007800343
• Molar Refractivity: 42.7523 cm^3
• Polarizability: 15.739951 Å^3
• Polar Surface Area: 37.53 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 95+%