N-butylpyridinium bis((trifluoromethyl)sulfonyl)imide

• CAS: 187863-42-9
• Catalog Number: ACM187863429
• Category: Pyridinium Ionic Liquids
• Molecular Weight: 416.3602792
• Molecular Formula: C11H14O4N2S2F6
• IUPAC Name: bis(trifluoromethylsulfonyl)azanide;1-butylpyridin-1-ium
• Canonical SMILES: CCCC[N+]1=CC=CC=C1.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F
• InChI: InChI=1S/C9H14N.C2F6NO4S2/c1-2-3-7-10-8-5-4-6-9-10;3-1(4,5)14(10,11)9-15(12,13)2(6,7)8/h4-6,8-9H,2-3,7H2,1H3;/q+1;-1
• InChI Key: XHIHMDHAPXMAQK-UHFFFAOYSA-N
• Abbreviation: BpyNTF2
• Chemical Formula: [Bpy]NTF2
• Complexity: 449
• Covalently-Bonded Unit Count: 2
• Exact Mass: 416.029918g/mol
• Formal Charge: 0
• H-Bond Acceptor: 11
• H-Bond Donor: 0
• Heavy Atom Count: 25
• Monoisotopic Mass: 416.029918g/mol
• Rotatable Bond Count: 5

Custom Q&A

What is the molecular formula of N-butylpyridinium bis((trifluoromethyl)sulfonyl)imide?

The molecular formula is C11H14F6N2O4S2.

What is the molecular weight of N-butylpyridinium bis((trifluoromethyl)sulfonyl)imide?

The molecular weight is 416.4 g/mol.

What are the synonyms for N-butylpyridinium bis((trifluoromethyl)sulfonyl)imide?

Synonyms include 1-Butylpyridinium Bis(trifluoromethanesulfonyl)imide and n-Butylpyridinium MFCD16038143.

When was N-butylpyridinium bis((trifluoromethyl)sulfonyl)imide created and modified in PubChem?

It was created on 2007-02-07 and last modified on 2023-12-30.

What is the IUPAC name of N-butylpyridinium bis((trifluoromethyl)sulfonyl)imide?

The IUPAC name is bis(trifluoromethylsulfonyl)azanide; 1-butylpyridin-1-ium.

What is the Canonical SMILES representation of N-butylpyridinium bis((trifluoromethyl)sulfonyl)imide?

The Canonical SMILES is CCCC[N+]1=CC=CC=C1.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F.

What is the InChIKey of N-butylpyridinium bis((trifluoromethyl)sulfonyl)imide?

The InChIKey is XHIHMDHAPXMAQK-UHFFFAOYSA-N.

What is the CAS number for N-butylpyridinium bis((trifluoromethyl)sulfonyl)imide?

The CAS number is 187863-42-9.

How many hydrogen bond acceptors are there in N-butylpyridinium bis((trifluoromethyl)sulfonyl)imide?

There are 11 hydrogen bond acceptors.

Is N-butylpyridinium bis((trifluoromethyl)sulfonyl)imide a canonicalized compound in PubChem?

Yes, it is a canonicalized compound in PubChem.