1,9-diiodononane

• ChemBase ID: 110328
• Molecular Formular: C9H18I2
• Molecular Mass: 380.04816
• Monoisotopic Mass: 379.94979658
• SMILES: ICCCCCCCCCI
• Canonical SMILES: ICCCCCCCCCI
• InChI: InChI=1S/C9H18I2/c10-8-6-4-2-1-3-5-7-9-11/h1-9H2
• InChIKey: QVXLFUVDXDMDFE-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 1,9-diiodononane
• IUPAC Traditional name: 1,9-diiodononane
• Synonyms: 1,9-DIIODONONANE

Database IDs

• CAS Number: 24613-65-8
• PubChem SID: 162089248
• PubChem CID: 90557

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 5.5322165
• LogD (pH = 7.4): 5.5322165
• Log P: 5.5322165
• Molar Refractivity: 69.635 cm^3
• Polarizability: 27.435822 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 8
• Lipinski's Rule of Five: false

DETAILS

MP Biomedicals - 05214572

MP Biomedicals Rare Chemical collection