dichloronickel hydrate

• ChemBase ID: 148649
• Molecular Formular: Cl2H2NiO
• Molecular Mass: 147.61468
• Monoisotopic Mass: 145.88361294
• SMILES: O.Cl[Ni]Cl
• Canonical SMILES: Cl[Ni]Cl.O
• InChI: InChI=1S/2ClH.Ni.H2O/h2*1H;;1H2/q;;+2;/p-2
• InChIKey: HGGYAQHDNDUIIQ-UHFFFAOYSA-L

NAMES AND DATABASE IDS

Names

• IUPAC name: dichloronickel hydrate
• IUPAC Traditional name: nickel chloride hydrate
• Synonyms: Nickel(II) chloride hydrate; 氯化镍(II) 水合物

Database IDs

• CAS Number: 69098-15-3
• EC Number: 231-743-0
• MDL Number: MFCD00149808
• PubChem SID: 24862425; 162242824
• PubChem CID: 16212333

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 0.519
• LogD (pH = 7.4): 0.519
• Log P: 0.519
• Molar Refractivity: 12.2726 cm^3
• Polarizability: 8.021537 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: solid
• Vapor Pressure: 1 mmHg ( 671 °C)

Safety Information

• European Hazard Symbols: Nature polluting (N); Toxic (T)
• UN Number: 3288
• German water hazard class: 3
• Hazard Class: 6.1
• Packing Group: 3
• Risk Statements: 49-61-23/25-38-42/43-48/23-50/53-68
• Safety Statements: 53-45-60-61
• GHS Pictograms: GHS06; GHS08; GHS09
• GHS Signal Word: Danger
• GHS Hazard statements: H301-H315-H317-H331-H334-H341-H350i-H360D-H372-H410
• GHS Precautionary statements: P201-P261-P273-P280-P301 + P310-P311
• Personal Protective Equipment: Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges
• RID/ADR: UN 3288 6.1/PG 3

Product Information

• Purity: 99.95% trace metals basis
• Compostion: Degree of hydration, 7-8
• Linear Formula: NiCl2 · xH2O

DETAILS

Sigma Aldrich - 364304

Packaging
100, 500 g in poly bottle