nickel(2+) ion hydrate diiodide

• ChemBase ID: 110757
• Molecular Formular: I2NiO
• Molecular Mass: 328.50174
• Monoisotopic Mass: 327.73920352
• SMILES: O.[Ni+2].[I-].[I-]
• Canonical SMILES: O.[Ni+2].[I-].[I-]
• InChI: InChI=1S/2HI.Ni.H2O/h2*1H;;1H2/q;;+2;/p-2
• InChIKey: CRCZMUGSQXVQMM-UHFFFAOYSA-L

NAMES AND DATABASE IDS

Names

• IUPAC name: nickel(2+) ion hydrate diiodide
• IUPAC Traditional name: nickel(2+) hydrate diiodide
• Synonyms: NICKEL IODIDE (OUS), ANHYDROUS

Database IDs

• CAS Number: 7790-34-3
• PubChem SID: 162096551
• PubChem CID: 25021990

CALCULATED PROPERTIES

• Acid pKa: 15.7
• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): -0.652
• LogD (pH = 7.4): -0.652
• Log P: -0.652
• Molar Refractivity: 3.7 cm^3
• Polarizability: 1.4714895 Å^3
• Polar Surface Area: 25.3 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

DETAILS

MP Biomedicals - 05216215

MP Biomedicals Rare Chemical collection