sodium dioxoalumanuide

• ChemBase ID: 129502
• Molecular Formular: AlHNaO2
• Molecular Mass: 82.978048
• Monoisotopic Mass: 82.96896218
• SMILES: O=[AlH-]=O.[Na+]
• Canonical SMILES: O=[AlH-]=O.[Na+]
• InChI: InChI=1S/Al.Na.2O/q-1;+1
• InChIKey: IYJYQHRNMMNLRH-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: sodium dioxoalumanuide
• IUPAC Traditional name: sodium dioxoalumanuide
• Synonyms: Sodium aluminium oxide; Sodium metaaluminate; Aluminate, (AlO21-), sodium; Sodium aluminate; Aluminum sodium oxide; Na/Al2O3; Sodium aluminum oxide; Sodium aluminate; 铝酸钠

Database IDs

• CAS Number: 11138-49-1; 1302-42-7
• EC Number: 234-391-6
• MDL Number: MFCD00085355
• PubChem SID: 162223795
• PubChem CID: 14766
• Wikipedia Title: Sodium_aluminate

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): 0.65592325
• LogD (pH = 7.4): 0.7449408
• Log P: 0.7472
• Molar Refractivity: 2.8858 cm^3
• Polarizability: 3.5677764 Å^3
• Polar Surface Area: 34.14 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Solubility: soluble in Alcohol; soluble in water
• Apperance: powder; white powder
• Melting Point: 1650 °C
• Density: 1.5 g/cm^3
• Refractive Index: 1.58

Safety Information

• RTECS: BD1600000
• European Hazard Symbols: Corrosive (C)
• UN Number: 3260
• German water hazard class: 1
• Hazard Class: 8
• Packing Group: 3
• Risk Statements: 35
• Safety Statements: 26-36/37/39-45
• GHS Pictograms: GHS05
• GHS Signal Word: Danger
• GHS Hazard statements: H314
• GHS Precautionary statements: 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 3260 8/PG 3

Product Information

• Grade: technical
• Impurities: ≤0.05% Fe (as Fe2O3)
• Cation Traces: Al (Al2O3): 50-56%; Na (as Na2O): 40-45%
• Quality: anhydrous
• Linear Formula: NaAlO2

DETAILS

Sigma Aldrich - 13404

Application
Used in isomerization of alkenes; isomerization of amines; a form of high surface area sodium metal.