zinc(2+) ion bis(nitrooxidane) hexahydrate

• ChemBase ID: 105066
• Molecular Formular: H12N2O12Zn
• Molecular Mass: 297.48148
• Monoisotopic Mass: 295.96816583
• SMILES: O.O.O.O.O.O.[Zn+2].[O-][N+](=O)[O-].[O-][N+](=O)[O-]
• Canonical SMILES: [O-][N+](=O)[O-].[O-][N+](=O)[O-].O.O.O.O.O.O.[Zn+2]
• InChI: InChI=1S/2NO3.6H2O.Zn/c2*2-1(3)4;;;;;;;/h;;6*1H2;/q2*-1;;;;;;;+2
• InChIKey: JGPSMWXKRPZZRG-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: zinc(2+) ion bis(nitrooxidane) hexahydrate; zinc(2+) ion hexahydrate dinitrate
• IUPAC Traditional name: zinc, ion (zn2+) hexahydrate dinitronate; zinc(2+) ion hexahydrate dinitrate
• Synonyms: ZINC NITRATE HEXAHYDRATE; Zinc nitrate hexahydrate; Zinc nitrate hexahydrate, Puratronic®; 硝酸锌 六水合物; 六水合硝酸锌, Puratronic®

Database IDs

• CAS Number: 10196-18-6
• EC Number: 231-943-8
• MDL Number: MFCD00149889
• Merck Index: 1410144
• PubChem SID: 24853706; 162092165; 24890307
• PubChem CID: 15865313

CALCULATED PROPERTIES

• Acid pKa: -1.3999903
• H Acceptors: 3
• H Donor: 0
• LogD (pH = 5.5): 0.8368004
• LogD (pH = 7.4): 0.8368004
• Log P: 0.8368004
• Molar Refractivity: 8.3471 cm^3
• Polarizability: 3.4222581 Å^3
• Polar Surface Area: 66.2 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: Crystalline Aggregates
• Melting Point: 36.4°C; ca 36°C
• Boiling Point: 105-130°C
• Density: 2.065 g/ml; 2.07

Safety Information

• Storage Condition: Room Temperature (15-30°C)
• RTECS: ZH4775000
• European Hazard Symbols: Oxidising (O); X; Irritant (Xi); Harmful (Xn)
• UN Number: 1514; UN1514
• German water hazard class: 3
• Hazard Class: 5.1
• Packing Group: 2; II
• Australian Hazchem: 1Y
• Risk Statements: 8-22-36/37/38; R:8-36
• Safety Statements: 17-26; 17-26-36/37; S:16-17-26-28
• EU Classification: O2
• EU Hazard Identification Number: 5.1B
• Emergency Response Guidebook(ERG) Number: 140
• TSCA Listed: 是
• GHS Pictograms: GHS03; GHS07
• GHS Signal Word: Danger
• GHS Hazard statements: H272-H302-H315-H319-H335; H302-H315-H319-H335
• GHS Precautionary statements: P220-P261-P305 + P351 + P338; P261-P305+P351+P338-P302+P352-P321-P405-P501A
• Personal Protective Equipment: dust mask type N95 (US), 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; 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
• RID/ADR: UN 1514 5.1/PG 2

Product Information

• Purity: ≥95.0%; ≥98%; ≥99.0% (KT); 98%; 99.998% (metals basis)
• Grade: purum; purum p.a.; reagent grade; SAJ first grade
• Cation Traces: Ca: ≤50 mg/kg; Cd: ≤50 mg/kg; Co: ≤50 mg/kg; Cu: ≤50 mg/kg; Fe: ≤20 mg/kg; Fe: ≤50 mg/kg; K: ≤100 mg/kg; Na: ≤100 mg/kg; Ni: ≤50 mg/kg; Pb: ≤100 mg/kg; Pb: ≤50 mg/kg
• Antion Traces: chloride (Cl-): ≤100 mg/kg; chloride (Cl-): ≤50 mg/kg; sulfate (SO42-): ≤100 mg/kg
• Quality: crystallized
• Linear Formula: Zn(NO3)2 · 6H2O

DETAILS

MP Biomedicals - 02158315

Hexahydrate, 98%
Crystalline

Sigma Aldrich - 228737

Packaging
100, 500 g in poly bottle
7 kg in poly drum
Application
Used to synthesize a new microporous, organically templated zinc phosphate. Such compounds have potential applications as catalysts or in other applications involving microporosity.1