4-hydrazinylpiperidine dihydrochloride

• ChemBase ID: 55522
• Molecular Formular: C5H15Cl2N3
• Molecular Mass: 188.0987
• Monoisotopic Mass: 187.06430286
• SMILES: C1NCCC(C1)NN.Cl.Cl
• Canonical SMILES: NNC1CCNCC1.Cl.Cl
• InChI: InChI=1S/C5H13N3.2ClH/c6-8-5-1-3-7-4-2-5;;/h5,7-8H,1-4,6H2;2*1H
• InChIKey: AFLRARNCCZQUGM-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 4-hydrazinylpiperidine dihydrochloride
• IUPAC Traditional name: 4-hydrazinylpiperidine dihydrochloride
• Synonyms: 4-Hydrazinopiperidine dihydrochloride; 4-hydrazinylpiperidine dihydrochloride

Database IDs

• MDL Number: MFCD18071345
• PubChem SID: 162060285
• PubChem CID: 22311317

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 3
• LogD (pH = 5.5): -4.6732554
• LogD (pH = 7.4): -3.8573077
• Log P: -1.1663561
• Molar Refractivity: 45.0521 cm^3
• Polarizability: 13.592126 Å^3
• Polar Surface Area: 50.08 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): -1.452

Safety Information

• Storage Warning: IRRITANT
• TSCA Listed: false

Product Information

• Purity: 95%