tetraethylazanium iodide

• ChemBase ID: 109628
• Molecular Formular: C8H20IN
• Molecular Mass: 257.15557
• Monoisotopic Mass: 257.06404765
• SMILES: [I-].CC[N+](CC)(CC)CC
• Canonical SMILES: CC[N+](CC)(CC)CC.[I-]
• InChI: InChI=1S/C8H20N.HI/c1-5-9(6-2,7-3)8-4;/h5-8H2,1-4H3;1H/q+1;/p-1
• InChIKey: UQFSVBXCNGCBBW-UHFFFAOYSA-M

NAMES AND DATABASE IDS

Names

• IUPAC name: tetraethylazanium iodide
• IUPAC Traditional name: tetraethylammonium iodide
• Synonyms: TETRAETHYLAMMONIUM IODIDE; Tetraethylammonium iodide; Tetamon iodide; Tetramon J; TEAI; 四乙基碘化铵

Database IDs

• CAS Number: 68-05-3
• EC Number: 200-676-9
• MDL Number: MFCD00011829
• Beilstein Number: 3562649
• PubChem SID: 24888412; 24854125; 162095160; 24888411
• PubChem CID: 6225
• Chemspider ID: 5990
• Wikipedia Title: Tetraethylammonium_iodide

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): -2.5449352
• LogD (pH = 7.4): -2.5449352
• Log P: -2.5449352
• Molar Refractivity: 54.8961 cm^3
• Polarizability: 16.958946 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 4
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Solubility: methanol: soluble0.1 g/mL, clear, colorless (hot); soluble in water
• Apperance: Colorless or yellowish crystalline solid
• Melting Point: >300 °C(lit.); 280°C (decomp.); ca 320°C dec.
• Density: 1.566 g/cm^3

Safety Information

• Storage Warning: Light Sensitive & Hygroscopic
• RTECS: BS7365000
• European Hazard Symbols: Irritant (Xi)
• German water hazard class: 3
• Risk Statements: 36/37/38
• Safety Statements: 26-36; 26-37
• TSCA Listed: 是
• GHS Pictograms: GHS07
• GHS Signal Word: Warning
• GHS Hazard statements: H315-H319-H335
• GHS Precautionary statements: P261-P305 + P351 + P338; P261-P305+P351+P338-P302+P352-P321-P405-P501A
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves

Product Information

• Purity: ≥98.5% (CHN); ≥99.0% (AT); 95+%; 98%; 98+%
• Grade: electrochemical grade; puriss.
• Impurities: ≤1% water
• Linear Formula: (C2H5)4N(I)

DETAILS

MP Biomedicals - 05211927

MP Biomedicals Rare Chemical collection

Sigma Aldrich - 235938

Packaging
25, 100 g in glass bottle

REFERENCES

• Reagent for conversion of ɑ?-enones in TFA to ?-iodo ketones in high yield: Tetrahedron, 39, 1529 (1983).