CAS 13462-90-3 Nickel(II) iodide (HCID 26038)

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Basic information

CAS: 13462-90-3
Standard SMILES: [I][Ni][I]
InChIKey: BFSQJYRFLQUZKX-UHFFFAOYSA-L
Molecular formula: I2Ni
Average molar mass: 312.502 g/mol
Monoisotopic mass: 311.74429

Names & identifiers

Preferred name: Nickel(II) iodide
IUPAC: diiodonickel
English name: NICKEL IODIDE
Molecular formula: I2Ni
Molecular weight: 312.5

Names & synonyms

Nickel(II) iodide13462-90-3Diiodonickelnickel(2+);diiodidenickel(II)iodideNickeliodide(NiI2)Nickel (II) iodideUltra Dry Nickel IodideNickel(II) iodide, powderNichel(II)idide hexahydrateNickel(II) iodide, anhydrousSCHEMBL119980

Show more names

NICKEL IODIDE (OUS)NICKEL IODIDENickel lodideNickel(II) iodnickeldiiodidenickelousiodidenickel(2+)iodide

AKOS015833439CS-W00114412640-78-7BP-12498Q421443Nickel(II) iodide, anhydrous, powder, 99.99% trace metals basis

Database identifiers

CAS: 13462-90-3
PubChem CID: 26038
EC Number: 236-666-6

Properties

Computed structural properties

Topological polar surface area: 0 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 0
Rotatable bonds: 0
Heavy atoms: 3
Formal charge: 0
Complexity: 2

Physicochemical properties

Melting point: 797 °C · 797 °C(lit.)
Boiling point: 94 · sublimes [LID94]
Density: 5.83 g/mL · 5.83 g/mL at 25 °C(lit.)
storage temp.: Keep in dark place,Inert atmosphere,Room temperature
solubility: 2 O: · H2O: slightly soluble(lit.)
form: Powder
color: black
Specific Gravity: 5.834 · 5.834
Water Solubility: Soluble in water and alcohols.
Sensitive: Hygroscopic
Merck: 13 · 13,6535
Exposure limits: 0.1 mg/m3NIOSH: · ACGIH: TWA 0.1 mg/m3NIOSH: IDLH 10 mg/m3; TWA 0.015 mg/m3
Stability: hygroscopic
Major Application: battery manufacturing
InChI: 1S/2HI.Ni/h2*1H;/q;;+2/p-2
InChIKey: BFSQJYRFLQUZKX-UHFFFAOYSA-L

Safety & regulation

Safety data

PPE: Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges
wgk: 3
tsca: TSCA listed
ridadr: UN 3260 8/PG 2
hs_code: 2827600090
risk_code: 45-61-42/43
Signal word: Danger
Symbol(GHS): GHS07,GHS08
hazard_code: T
safety_code: 53-22-26-36/37/39-45
hazard_class: 6.1(b)
Storage Class: 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
packing_group: III
target organs: Respiratory Tract
Hazard statements: H317-H350-H360
Limited Quantities: 5.0 kg (11 lbs) (solid)
Excepted Quantities: Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
Hazard Classifications: Aquatic Acute 1Aquatic Chronic 1Carc. 1A InhalationMuta. 2Repr. 1BResp. Sens. 1Skin Sens. 1STOT RE 1 Inhalation
Precautionary statements: P201-P280-P302+P352-P308+P313
Hazardous Substances Data: 13462-90-3(Hazardous Substances Data)

Chemistry & industry

Applications · 3 items

UsesNickel Diiodide is used in preparation of Nickel complexes for migratory reductive cross-coupling.

UsesStrongly accelerates Sml2 mediated homocoupling of imines into vicinal diamines and heterocoupling reactions between imines and ketones.

UsesStrongly accelerates Sml2 mediated homocoupling of imines into vicinal diamines and heterocoupling reactions between imines and ketones.1

Preparation methods · 1 item

PreparationNickel iodide can be prepared by dehydration of the hexahydrate or by the metathetic reaction between sodium iodide and nickel(II) chloride or nitrate in ethanol. It has the CdCl2 type lattice and is paramagnetic down to 75°K. Only one hydrate is well characterized—the blue-green NiI26H20 ; unlike the other halide hexahydrates, this contains [Ni(H2O)6]2+ cations.