tetramethylazanium chloride

• ChemBase ID: 135287
• Molecular Formular: C4H12ClN
• Molecular Mass: 110.5911889
• Monoisotopic Mass: 110.06286196
• SMILES: C[15N+](C)(C)C.[Cl-]
• Canonical SMILES: C[15N+](C)(C)C.[Cl-]
• InChI: InChI=1S/C4H12N.ClH/c1-5(2,3)4;/h1-4H3;1H/q+1;/p-1/i5+1
• InChIKey: OKIZCWYLBDKLSU-LJJZSEGWSA-M

NAMES AND DATABASE IDS

Names

• IUPAC name: tetramethylazanium chloride
• IUPAC Traditional name: tetramethylammonium chloride
• Synonyms: Tetramethylammonium-15N chloride; 四甲基铵-15N 氯化物

Database IDs

• CAS Number: 287476-08-8
• MDL Number: MFCD01074398
• PubChem SID: 24882000; 162229562
• PubChem CID: 16217571

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

• Melting Point: >300 °C
• Mass Shift: M+1

Safety Information

• European Hazard Symbols: Toxic (T)
• UN Number: 2811
• German water hazard class: 3
• Hazard Class: 6.1
• Packing Group: 2
• Risk Statements: 21-25-36/37/38
• Safety Statements: 26-28-36/37-45
• GHS Pictograms: GHS06
• GHS Signal Word: Danger
• GHS Hazard statements: H301-H312-H315-H319-H335
• GHS Precautionary statements: P261-P280-P301 + P310-P305 + P351 + P338
• Personal Protective Equipment: Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges
• RID/ADR: UN 2811 6.1/PG 2

Product Information

• Isotopic Purity: 98 atom % 15N
• Mol. Weight: mol wt 110.59 by atom % calculation
• Linear Formula: (CH3)415N+Cl-

DETAILS

Sigma Aldrich - 608823

Packaging
This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.