diiodonickel hexaamine

• ChemBase ID: 152919
• Molecular Formular: H18I2N6Ni
• Molecular Mass: 414.68546
• Monoisotopic Mass: 413.90358351
• SMILES: N.N.N.N.N.N.[Ni](I)I
• Canonical SMILES: I[Ni]I.N.N.N.N.N.N
• InChI: InChI=1S/2HI.6H3N.Ni/h2*1H;6*1H3;/q;;;;;;;;+2/p-2
• InChIKey: FQWFGADADYOXJU-UHFFFAOYSA-L

NAMES AND DATABASE IDS

Names

• IUPAC name: diiodonickel hexaamine
• IUPAC Traditional name: diiodonickel hexaamine
• Synonyms: Hexaamminenickel(II) iodide; 碘化镍六胺络合物

Database IDs

• CAS Number: 13859-68-2
• MDL Number: MFCD04039936
• PubChem SID: 24880767; 162247062
• PubChem CID: 16217289

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 1.1172
• LogD (pH = 7.4): 1.1172
• Log P: 1.1172
• Molar Refractivity: 26.6816 cm^3
• Polarizability: 15.075985 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: powder

Safety Information

• European Hazard Symbols: Toxic (T)
• German water hazard class: 3
• Risk Statements: 45-42/43
• Safety Statements: 36/37/39-45
• GHS Pictograms: GHS08
• GHS Signal Word: Danger
• GHS Hazard statements: H317-H334-H350
• GHS Precautionary statements: P201-P261-P280-P308 + P313
• Personal Protective Equipment: Eyeshields, Faceshields, full-face particle respirator type N100 (US), Gloves, respirator cartridge type N100 (US), type P1 (EN143) respirator filter, type P3 (EN 143) respirator cartridges

Product Information

• Purity: 99.999% trace metals basis
• Linear Formula: [Ni(NH3)6]I2

DETAILS

Sigma Aldrich - 574953

Packaging
25 g in glass bottle