triethylamine pentahydrofluoride

• ChemBase ID: 93906
• Molecular Formular: C6H20F5N
• Molecular Mass: 201.221716
• Monoisotopic Mass: 201.15159075
• SMILES: N(CC)(CC)CC.F.F.F.F.F
• Canonical SMILES: CCN(CC)CC.F.F.F.F.F
• InChI: InChI=1S/C6H15N.5FH/c1-4-7(5-2)6-3;;;;;/h4-6H2,1-3H3;5*1H
• InChIKey: UQIRAGRGIYWEDH-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: triethylamine pentahydrofluoride
• IUPAC Traditional name: TEN pentahydrofluoride
• Synonyms: Tris(ethyl)amine pentahydrofluoride

Database IDs

• CAS Number: 94527-74-9
• PubChem SID: 162080561
• PubChem CID: 10954597

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): -2.2147028
• LogD (pH = 7.4): -1.4690653
• Log P: 1.2605933
• Molar Refractivity: 34.2339 cm^3
• Polarizability: 13.342089 Å^3
• Polar Surface Area: 3.24 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• Storage Warning: Very Toxic/Corrosive/Keep Cold