2-(2-hydrazinylethyl)pyridine dihydrochloride

• ChemBase ID: 239625
• Molecular Formular: C7H13Cl2N3
• Molecular Mass: 210.10422
• Monoisotopic Mass: 209.04865279
• SMILES: n1c(CCNN)cccc1.Cl.Cl
• Canonical SMILES: NNCCc1ccccn1.Cl.Cl
• InChI: InChI=1S/C7H11N3.2ClH/c8-10-6-4-7-3-1-2-5-9-7;;/h1-3,5,10H,4,6,8H2;2*1H
• InChIKey: PKUXJGGRQMKJBB-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-(2-hydrazinylethyl)pyridine dihydrochloride
• IUPAC Traditional name: 2-(2-hydrazinylethyl)pyridine dihydrochloride
• Synonyms: 2-(2-hydrazinylethyl)pyridine dihydrochloride

Database IDs

• MDL Number: MFCD01691707
• PubChem SID: 164295535
• PubChem CID: 204818

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 2
• LogD (pH = 5.5): -0.2659878
• LogD (pH = 7.4): 0.010223406
• Log P: 0.015171037
• Molar Refractivity: 51.5286 cm^3
• Polarizability: 15.891568 Å^3
• Polar Surface Area: 50.94 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): -0.464

Product Information

• Purity: 95%