phosphoric acid dodecakis(trioxomolybdenum) hydrate

• ChemBase ID: 156321
• Molecular Formular: H5Mo12O41P
• Molecular Mass: 1843.508861
• Monoisotopic Mass: 1866.66928221
• SMILES: O.OP(=O)(O)O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O
• Canonical SMILES: OP(=O)(O)O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O.O
• InChI: InChI=1S/12Mo.H3O4P.H2O.36O/c;;;;;;;;;;;;1-5(2,3)4;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/h;;;;;;;;;;;;(H3,1,2,3,4);1H2
• InChIKey: PDDXOPNEMCREGN-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: phosphoric acid dodecakis(trioxomolybdenum) hydrate
• IUPAC Traditional name: dodecakis(molybdenum trioxide) phosphoric acid hydrate
• Synonyms: Molybdophosphoric acid; Phosphomolybdic acid hydrate; 钼磷酸; 磷钼酸 水合物

Database IDs

• CAS Number: 51429-74-4
• EC Number: 234-713-5
• MDL Number: MFCD00149913
• PubChem SID: 162250459; 24898845; 24867014; 24852959; 24887473
• PubChem CID: 16211564

CALCULATED PROPERTIES

• Acid pKa: 1.7961261
• H Acceptors: 4
• H Donor: 3
• LogD (pH = 5.5): -3.3916447
• LogD (pH = 7.4): -3.9718332
• Log P: -1.0201038
• Molar Refractivity: 14.6519 cm^3
• Polarizability: 5.927813 Å^3
• Polar Surface Area: 77.76 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: false

PROPERTIES

Physical Property

• Apperance: moist crystals
• Density: 1.62 g/mL at 25 °C(lit.)

Safety Information

• European Hazard Symbols: Corrosive (C); Oxidising (O)
• UN Number: 3084
• German water hazard class: 3
• Hazard Class: 8
• Packing Group: 2
• Risk Statements: 8-34
• Safety Statements: 17-26-36/37/39-45
• GHS Pictograms: GHS03; GHS05
• GHS Signal Word: Danger
• GHS Hazard statements: H272-H314
• GHS Precautionary statements: P220-P280-P305 + P351 + P338-P310
• 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
• RID/ADR: UN 3084 8/PG 2

Product Information

• Purity: ≥99.99% trace metals basis
• Grade: ACS reagent; for microscopy; puriss. p.a.; purum p.a.; SAJ special grade
• Impurities: <100 ppm total metallic impurities; ≤0.002% ammonium (NH4); ≤0.01% insolubles
• Cation Traces: Ca: ≤0.02%; Ca: ≤100 mg/kg; Ca: ≤50 mg/kg; Cd: ≤5 mg/kg; Cd: ≤50 mg/kg; Co: ≤20 mg/kg; Co: ≤50 mg/kg; Cr: ≤5 mg/kg; Cu: ≤10 mg/kg; Cu: ≤5 mg/kg; Cu: ≤50 mg/kg; Fe: ≤0.005%; Fe: ≤100 mg/kg; Fe: ≤50 mg/kg; heavy metals (as Pb): ≤0.005%; heavy metals: ≤0.005%; K: ≤100 mg/kg; K: ≤50 mg/kg; Mg: ≤20 mg/kg; Mn: ≤100 mg/kg; Na: ≤100 mg/kg; Na: ≤50 mg/kg; NH4+: ≤0.01%; NH4+: ≤30 mg/kg; Ni: ≤10 mg/kg; Ni: ≤50 mg/kg; Pb: ≤20 mg/kg; Pb: ≤50 mg/kg; Zn: ≤50 mg/kg
• Antion Traces: chloride (Cl-): ≤0.02%; chloride (Cl-): ≤50 mg/kg; sulfate (SO42-): ≤0.025%; sulfate (SO42-): ≤100 mg/kg
• Loss on Drying: ≤23% loss on drying, 120 °C; 21-23% loss on drying, 110 °C
• Linear Formula: H3[P(Mo3O10)4] · xH2O

DETAILS

Sigma Aldrich - 79560

Application
A precursor to hybrid organic-inorganic based molecular batteries with applications as cation-insertion electrodes.1
Other Notes
Review: of the folin phenol method for the quantitative determination of proteins2

Sigma Aldrich - 79563

Application
A precursor to hybrid organic-inorganic based molecular batteries with applications as cation-insertion electrodes.1

Sigma Aldrich - P7390

Application
A precursor to hybrid organic-inorganic based molecular batteries with applications as cation-insertion electrodes.1
Packaging
25, 100, 500 g in poly bottle

Sigma Aldrich - 431400

Application
A precursor to hybrid organic-inorganic based molecular batteries with applications as cation-insertion electrodes.2
Employed in preparation of a hybrid organic-inorganic, electroactive material with potential application as a cation-insertion electrode in batteries.1
Reactant for preparation of:
• Catalysts for the nitration of aromatic compounds
• Highly dispersed MoOx/CNTs (carbon nanotubes) as a support for Pt catalysts
• Reduced molybdophosphate mixed-valence Keggin clusters
• Polyoxometalate (POM) hybrid materials based on Keggin polyanion building blocks
• Luminescent Langmuir-Blodgett films
• Anchored Wilkinson catalyst
Features and Benefits
Meets A.C.S. reagent specifications.
Packaging
10, 50 g in poly bottle

Sigma Aldrich - 31426

Application
A precursor to hybrid organic-inorganic based molecular batteries with applications as cation-insertion electrodes.1

Sigma Aldrich - 221856

Application
A precursor to hybrid organic-inorganic based molecular batteries with applications as cation-insertion electrodes.2
Employed in preparation of a hybrid organic-inorganic, electroactive material with potential application as a cation-insertion electrode in batteries.1
Packaging
25, 100 g in poly bottle
5 g in glass bottle

Sigma Aldrich - 24-2580

Application
A precursor to hybrid organic-inorganic based molecular batteries with applications as cation-insertion electrodes.1