octan-2-ylhydrazine

• ChemBase ID: 128700
• Molecular Formular: C8H20N2
• Molecular Mass: 144.2578
• Monoisotopic Mass: 144.16264865
• SMILES: CCCCCCC(C)NN
• Canonical SMILES: CCCCCCC(NN)C
• InChI: InChI=1S/C8H20N2/c1-3-4-5-6-7-8(2)10-9/h8,10H,3-7,9H2,1-2H3
• InChIKey: FODQIVGFADUBKE-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: octan-2-ylhydrazine
• IUPAC Systematic name: Octan-2-ylhydrazine
• IUPAC Traditional name: octamoxin
• Synonyms: Octamoxin

Database IDs

• CAS Number: 4684-87-1
• PubChem SID: 162223006
• PubChem CID: 20811
• Chemspider ID: 19587
• Unique Ingredient Identifier: 0HXY3M6S54
• Wikipedia Title: Octamoxin

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): 1.7071544
• LogD (pH = 7.4): 2.250026
• Log P: 2.2640657
• Molar Refractivity: 56.9911 cm^3
• Polarizability: 18.343885 Å^3
• Polar Surface Area: 38.05 Å^2
• Rotatable Bonds: 6
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Boiling Point: 228°C
• Density: 0.831 g/mL

Pharmacology Properties

• Admin Routes: Oral