triethyl(methyl)azanium oxidanide

• ChemBase ID: 146227
• Molecular Formular: C7H19NO
• Molecular Mass: 133.23186
• Monoisotopic Mass: 133.14666423
• SMILES: CC[N+](C)(CC)CC.[OH-]
• Canonical SMILES: CC[N+](CC)(CC)C.[OH-]
• InChI: InChI=1S/C7H18N.H2O/c1-5-8(4,6-2)7-3;/h5-7H2,1-4H3;1H2/q+1;/p-1
• InChIKey: JAJRRCSBKZOLPA-UHFFFAOYSA-M

NAMES AND DATABASE IDS

Names

• IUPAC name: triethyl(methyl)azanium oxidanide
• IUPAC Traditional name: triethyl(methyl)azanium oxidanide
• Synonyms: Methyltriethylammonium hydroxide; Triethylmethylammonium hydroxide solution; 甲基三乙基氢氧化铵; 三乙基甲基氢氧化铵 溶液

Database IDs

• CAS Number: 109334-81-8
• MDL Number: MFCD00216635
• Beilstein Number: 3689200
• PubChem SID: 162240426; 24867447
• PubChem CID: 14647552

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): -2.9017432
• LogD (pH = 7.4): -2.9017432
• Log P: -2.9017432
• Molar Refractivity: 50.1475 cm^3
• Polarizability: 15.112125 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Boiling Point: 102 °C
• Density: 1.011 g/mL at 25 °C
• Refractive Index: n20/D 1.373

Safety Information

• European Hazard Symbols: Corrosive (C)
• UN Number: 3267
• German water hazard class: 3
• Hazard Class: 8
• Packing Group: 2
• 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: Faceshields, full-face respirator (US), Gloves, Goggles, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
• RID/ADR: UN 3267 8/PG 2

Product Information

• Concentration: 20 wt. % in H2O
• Linear Formula: (C2H5)3N(OH)CH3

DETAILS

Sigma Aldrich - 438367

Packaging
250 mL in glass bottle