5-hydrazinyl-2-methylpyridine hydrochloride

• ChemBase ID: 70244
• Molecular Formular: C6H10ClN3
• Molecular Mass: 159.6167
• Monoisotopic Mass: 159.05632502
• SMILES: c1(ccc(cn1)NN)C.Cl
• Canonical SMILES: NNc1ccc(nc1)C.Cl
• InChI: InChI=1S/C6H9N3.ClH/c1-5-2-3-6(9-7)4-8-5;/h2-4,9H,7H2,1H3;1H
• InChIKey: PULVNVPJXXJEAS-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 5-hydrazinyl-2-methylpyridine hydrochloride
• IUPAC Traditional name: 5-hydrazinyl-2-methylpyridine hydrochloride
• Synonyms: 1-(6-Methylpyridin-3-yl)hydrazine hydrochloride

Database IDs

• CAS Number: 896133-77-0
• MDL Number: MFCD10698812
• PubChem SID: 162035967
• PubChem CID: 24820511

CALCULATED PROPERTIES

• Polarizability: 13.754655 Å^3
• Polar Surface Area: 50.94 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true
• H Acceptors: 3
• H Donor: 2
• LogD (pH = 5.5): 0.078051455
• LogD (pH = 7.4): 0.275572
• Log P: 0.27858618
• Molar Refractivity: 38.1993 cm^3

PROPERTIES

Safety Information

• Storage Warning: IRRITANT
• TSCA Listed: false

Product Information

• Purity: 95+%