cyclobutylhydrazine hydrochloride

• ChemBase ID: 70821
• Molecular Formular: C4H11ClN2
• Molecular Mass: 122.59654
• Monoisotopic Mass: 122.06107604
• SMILES: N(N)C1CCC1.Cl
• Canonical SMILES: NNC1CCC1.Cl
• InChI: InChI=1S/C4H10N2.ClH/c5-6-4-2-1-3-4;/h4,6H,1-3,5H2;1H
• InChIKey: AQOZZSWECZTDNR-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: cyclobutylhydrazine hydrochloride
• IUPAC Traditional name: cyclobutylhydrazine hydrochloride
• Synonyms: Cyclobutylhydrazine hydrochloride; 1-Cyclobutylhydrazine hydrochloride

Database IDs

• CAS Number: 158001-21-9
• MDL Number: MFCD06658415
• PubChem SID: 162036531
• PubChem CID: 19432792

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): -0.4118067
• LogD (pH = 7.4): 0.08884386
• Log P: 0.10001892
• Molar Refractivity: 36.7079 cm^3
• Polarizability: 10.223148 Å^3
• Polar Surface Area: 38.05 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• Storage Warning: IRRITANT
• TSCA Listed: false

Product Information

• Purity: 95+%