3-hydrazinylpyridine dihydrochloride

• ChemBase ID: 24709
• Molecular Formular: C5H9Cl2N3
• Molecular Mass: 182.05106
• Monoisotopic Mass: 181.01735266
• SMILES: n1cc(NN)ccc1.Cl.Cl
• Canonical SMILES: NNc1cccnc1.Cl.Cl
• InChI: InChI=1S/C5H7N3.2ClH/c6-8-5-2-1-3-7-4-5;;/h1-4,8H,6H2;2*1H
• InChIKey: QJFANABRDIUIEI-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 3-hydrazinylpyridine dihydrochloride
• IUPAC Traditional name: 3-hydrazinylpyridine dihydrochloride
• Synonyms: 3-Hydrazinylpyridine dihydrochloride; 3-Hydrazinopyridine dihydrochloride

Database IDs

• CAS Number: 364727-74-2
• MDL Number: MFCD08576202
• PubChem SID: 160988016
• PubChem CID: 17132489

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 2
• LogD (pH = 5.5): 0.0054517193
• LogD (pH = 7.4): 0.14515205
• Log P: 0.14721599
• Molar Refractivity: 33.6078 cm^3
• Polarizability: 11.989916 Å^3
• Polar Surface Area: 50.94 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• Storage Warning: IRRITANT
• TSCA Listed: false

Product Information

• Purity: 95+%; 98%