5-amino-1H-indazol-3-ol

• ChemBase ID: 310065
• Molecular Formular: C7H7N3O
• Molecular Mass: 149.14998
• Monoisotopic Mass: 149.05891186
• SMILES: c12c(n[nH]c1ccc(c2)N)O
• Canonical SMILES: Nc1ccc2c(c1)c(O)n[nH]2
• InChI: InChI=1S/C7H7N3O/c8-4-1-2-6-5(3-4)7(11)10-9-6/h1-3H,8H2,(H2,9,10,11)
• InChIKey: XAFHVHYSJZHBMY-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 5-amino-1H-indazol-3-ol
• IUPAC Traditional name: 5-amino-1H-indazol-3-ol
• Synonyms: 5-amino-1H-indazol-3-ol

Database IDs

• CAS Number: 89792-09-6

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 3
• LogD (pH = 5.5): 0.7567905
• LogD (pH = 7.4): 0.7512273
• Log P: 0.75827396
• Molar Refractivity: 43.0679 cm^3
• Polarizability: 16.380272 Å^3
• Polar Surface Area: 74.93 Å^2