tetramethylazanium iodide

• ChemBase ID: 109328
• Molecular Formular: C4H12IN
• Molecular Mass: 201.04925
• Monoisotopic Mass: 201.00144739
• SMILES: [I-].C[N+](C)(C)C
• Canonical SMILES: C[N+](C)(C)C.[I-]
• InChI: InChI=1S/C4H12N.HI/c1-5(2,3)4;/h1-4H3;1H/q+1;/p-1
• InChIKey: RXMRGBVLCSYIBO-UHFFFAOYSA-M

NAMES AND DATABASE IDS

Names

• IUPAC name: tetramethylazanium iodide
• IUPAC Traditional name: tetramethylammonium ion iodide; tetramethylammonium iodide
• Synonyms: TETRAMETHYLAMMONIUM IODIDE; Tetramethylammonium iodide; 四甲基碘化铵

Database IDs

• CAS Number: 75-58-1
• EC Number: 200-881-3
• MDL Number: MFCD00011629
• Beilstein Number: 3620030
• Merck Index: 149225
• PubChem SID: 162094957; 24888948; 24854126
• PubChem CID: 6381

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): -3.9721673
• LogD (pH = 7.4): -3.9721673
• Log P: -3.9721673
• Molar Refractivity: 35.9017 cm^3
• Polarizability: 9.572162 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Solubility: Slightly soluble in water. Insoluble in chloroform, ether
• Melting Point: >300 °C(lit.); >300°C

Safety Information

• Storage Warning: Light Sensitive & Hygroscopic
• RTECS: PA1050000
• European Hazard Symbols: Toxic (T); Irritant (Xi)
• UN Number: UN2811
• German water hazard class: 3
• Hazard Class: 6.1
• Packing Group: III
• Risk Statements: 25-36/37/38; 36/37/38
• Safety Statements: 26-36; 26-36/37-45
• TSCA Listed: 是
• GHS Pictograms: GHS06; GHS07
• GHS Signal Word: Warning
• GHS Hazard statements: H301-H315-H319-H335; H315-H319-H335
• GHS Precautionary statements: P261-P305 + P351 + P338; P280F-P305+P351+P338-P309-P310
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves

Product Information

• Purity: ≥99.0% (AT); 95+%; 99%
• Grade: puriss.
• Linear Formula: (CH3)4N(I)

DETAILS

MP Biomedicals - 05210659

MP Biomedicals Rare Chemical collection

Sigma Aldrich - 235946

Application
Facile iodination of aromatic compounds including anilines, acids and alcohols.1
Packaging
25, 100 g in glass bottle