4,5,6,7-tetrahydro-2H-indazol-6-amine dihydrochloride

• ChemBase ID: 310293
• Molecular Formular: C7H13Cl2N3
• Molecular Mass: 210.10422
• Monoisotopic Mass: 209.04865279
• SMILES: c12c(c[nH]n1)CCC(C2)N.Cl.Cl
• Canonical SMILES: NC1CCc2c(C1)n[nH]c2.Cl.Cl
• InChI: InChI=1S/C7H11N3.2ClH/c8-6-2-1-5-4-9-10-7(5)3-6;;/h4,6H,1-3,8H2,(H,9,10);2*1H
• InChIKey: HOFMBFYWCUCJBX-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 4,5,6,7-tetrahydro-2H-indazol-6-amine dihydrochloride
• IUPAC Traditional name: 4,5,6,7-tetrahydro-2H-indazol-6-amine dihydrochloride
• Synonyms: 4,5,6,7-tetrahydro-2H-indazol-6-amine dihydrochloride

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): -2.7444134
• LogD (pH = 7.4): -2.0416248
• Log P: 0.2659071
• Molar Refractivity: 39.9768 cm^3
• Polarizability: 15.139101 Å^3
• Polar Surface Area: 54.7 Å^2