2,2,2-trifluoro-N,N-bis(trimethylsilyl)acetamide

• ChemBase ID: 303480
• Molecular Formular: C8H18F3NOSi2
• Molecular Mass: 257.4008296
• Monoisotopic Mass: 257.08790193
• SMILES: C[Si](C)(C)N(C(=O)C(F)(F)F)[Si](C)(C)C
• Canonical SMILES: O=C(C(F)(F)F)N([Si](C)(C)C)[Si](C)(C)C
• InChI: InChI=1S/C8H18F3NOSi2/c1-14(2,3)12(15(4,5)6)7(13)8(9,10)11/h1-6H3
• InChIKey: RZYHXKLKJRGJGP-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2,2,2-trifluoro-N,N-bis(trimethylsilyl)acetamide
• IUPAC Traditional name: 2,2,2-trifluoro-N,N-bis(trimethylsilyl)acetamide
• Synonyms: N,O-Bis(trimethylsilyl)trifluoroacetamide; N,O-双三甲硅基三氟乙酰胺; N

Database IDs

• CAS Number: 25561-30-2
• EC Number: 247-103-9
• MDL Number: MFCD00008269

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 3.4872
• LogD (pH = 7.4): 3.4872
• Log P: 3.4872
• Molar Refractivity: 48.5567 cm^3
• Polarizability: 21.973127 Å^3
• Polar Surface Area: 20.31 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: Liquid; Liquid, Ampouled under argon

Safety Information

• Storage Warning: Moisture Sensitive
• European Hazard Symbols: Corrosive (C)
• UN Number: UN2924
• Hazard Class: 3
• Packing Group: III
• Risk Statements: 10-34
• Safety Statements: 20-26-36/37/39-45
• TSCA Listed: 是
• GHS Pictograms: GHS02; GHS05
• GHS Hazard statements: H314-H318-H226
• GHS Precautionary statements: P210-P241-P303+P361+P353-P305+P351+P338-P405-P501A

Product Information

• Purity: with 1% TMCS; with 10% TMCS
• Packaging: packaged under Argon in resealable ChemSeal? bottles