1H-pyrrolo[2,3-c]pyridin-2-ol

• ChemBase ID: 242278
• Molecular Formular: C7H6N2O
• Molecular Mass: 134.13534
• Monoisotopic Mass: 134.04801282
• SMILES: c1([nH]c2c(c1)ccnc2)O
• Canonical SMILES: Oc1cc2c([nH]1)cncc2
• InChI: InChI=1S/C7H6N2O/c10-7-3-5-1-2-8-4-6(5)9-7/h1-4,9-10H
• InChIKey: TUODBRBWIFSNKH-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 1H-pyrrolo[2,3-c]pyridin-2-ol
• IUPAC Traditional name: 1H-pyrrolo[2,3-c]pyridin-2-ol
• Synonyms: 1H-pyrrolo[2,3-c]pyridin-2-ol

Database IDs

• MDL Number: MFCD12923749
• PubChem SID: 164298188
• PubChem CID: 11651217

CALCULATED PROPERTIES

• Log P: 0.6400611
• Molar Refractivity: 36.2218 cm^3
• Polarizability: 15.258006 Å^3
• Polar Surface Area: 48.91 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true
• Acid pKa: 8.752332
• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): 0.49653137
• LogD (pH = 7.4): 0.6192856

PROPERTIES

Physical Property

• Hydrophobicity(logP): 1.224

Product Information

• Purity: 95%