dicopper(2+) ion pentahydrate tetranitrate

• ChemBase ID: 148205
• Molecular Formular: Cu2H10N4O17
• Molecular Mass: 465.188
• Monoisotopic Mass: 463.86328988
• SMILES: [N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].O.O.O.O.O.[Cu+2].[Cu+2]
• Canonical SMILES: [O-][N+](=O)[O-].[O-][N+](=O)[O-].[O-][N+](=O)[O-].[O-][N+](=O)[O-].O.O.O.O.O.[Cu+2].[Cu+2]
• InChI: InChI=1S/2Cu.4NO3.5H2O/c;;4*2-1(3)4;;;;;/h;;;;;;5*1H2/q2*+2;4*-1
• InChIKey: IZDJJEMZQZQQQQ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: dicopper(2+) ion pentahydrate tetranitrate
• IUPAC Traditional name: dicopper(2+) ion pentahydrate tetranitrate
• Synonyms: Cupric nitrate hemi(pentahydrate); Copper(II) nitrate hemi(pentahydrate); Cupric nitrate 半(五水合物); 硝酸铜 半(五水合物); 硝酸铜 水合物; 硝酸铜 半(五水合物)

Database IDs

• CAS Number: 19004-19-4
• EC Number: 221-838-5
• MDL Number: MFCD02253001
• PubChem SID: 24847851; 162242382; 24870442; 24853378
• PubChem CID: 167780

CALCULATED PROPERTIES

• Acid pKa: -1.3999903
• H Acceptors: 3
• H Donor: 0
• LogD (pH = 5.5): -2.3479722
• LogD (pH = 7.4): -2.3479848
• Log P: 0.028413763
• Molar Refractivity: 9.8534 cm^3
• Polarizability: 3.4222581 Å^3
• Polar Surface Area: 68.88 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: crystalline
• pH: 3.5-4.5 (20 °C, 5%)

Safety Information

• RTECS: QU7400000
• European Hazard Symbols: Nature polluting (N); Oxidising (O); Harmful (Xn)
• UN Number: 3085
• German water hazard class: 3
• Hazard Class: 5.1
• Packing Group: 2
• Risk Statements: 8-22-38-41-50/53
• Safety Statements: 26-39-60-61
• GHS Pictograms: GHS03; GHS05; GHS07; GHS09
• GHS Signal Word: Danger
• GHS Hazard statements: H272-H302-H315-H318-H400
• GHS Precautionary statements: P220-P273-P280-P305 + P351 + P338
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves
• RID/ADR: UN 3085 5.1/PG 2

Product Information

• Purity: ≤26% Cu basis; ≥98%; ≥99.99% trace metals basis; 98%; 98.0-102.0% (ACS specification); 99-102%
• Grade: ACS reagent; puriss. p.a.; purum
• Impurities: <100 ppm total metallic impurities; ≤0.003% water insolubles; ≤0.01% insoluble matter in dilute HNO3; ≤0.01% insolubles
• Cation Traces: Ca: ≤0.005%; Ca: ≤50 mg/kg; Fe: ≤0.005%; Fe: ≤20 mg/kg; Fe: ≤50 mg/kg; K: ≤0.005%; K: ≤100 mg/kg; Mg: ≤10 mg/kg; Na: ≤0.01%; Na: ≤100 mg/kg; Ni: ≤0.01%; Ni: ≤20 mg/kg; Pb: ≤0.001%; Pb: ≤10 mg/kg; Zn: ≤10 mg/kg
• Antion Traces: chloride (Cl-): ≤0.002%; chloride (Cl-): ≤10 mg/kg; chloride (Cl-): ≤50 mg/kg; sulfate (SO42-): ≤0.01%; sulfate (SO42-): ≤100 mg/kg; sulfate (SO42-): ≤50 mg/kg
• Linear Formula: Cu(NO3)2 · 2.5H2O

DETAILS

Sigma Aldrich - 467855

Packaging
50, 250 g in poly bottle
Application
Catalyzes oxidative coupling of 2,6-dimethylphenol to produce a polymer which is an important engineering material.1

Sigma Aldrich - 223395

Packaging
100, 500 g in poly bottle
2.5 kg in poly bottle
Application
Catalyzes oxidative coupling of 2,6-dimethylphenol to produce a polymer which is an important engineering material.1