1-Ethyl-2,3-dimethylimidazolium tetrafluoroborate

• CAS: 307492-75-7
• Catalog Number: ACM307492757
• Category: Imidazolium Ionic Liquids
• Molecular Weight: 212
• Molecular Formula: C7H13BF4N2
• IUPAC Name: 1-ethyl-2,3-dimethylimidazol-3-ium;tetrafluoroborate
• SMILES: [B-](F)(F)(F)F.CCN1C=C[N+](=C1C)C
• InChI: 1S/C7H13N2.BF4/c1-4-9-6-5-8(3)7(9)2;2-1(3,4)5/h5-6H,4H2,1-3H3;/q+1;-1
• InChI Key: KNIWGPCMWBGRBE-UHFFFAOYSA-N
• Melting Point: 15 °C (lit.)
• Flash Point: Not applicable
• Appearance: powder
• Storage: 2-8°C
• Abbreviation: EDMIMBF4
• Chemical Formula: EDMIMBF4
• Complexity: 112
• Covalently-Bonded Unit Count: 2
• Exact Mass: 212.110791g/mol
• Formal Charge: 0
• H-Bond Acceptor: 5
• H-Bond Donor: 0
• Heavy Atom Count: 14
• MDL Number: MFCD08458929
• Monoisotopic Mass: 212.110791g/mol
• Refractive Index: n20/D 1.433
• Rotatable Bond Count: 1

Custom Q&A

What is the molecular formula of 1-ethyl-2,3-dimethylimidazolium tetrafluoroborate?

The molecular formula is C7H13BF4N2.

When was 1-ethyl-2,3-dimethylimidazolium tetrafluoroborate created and modified?

It was created on December 5, 2007, and last modified on December 30, 2023.

What is the IUPAC name of 1-ethyl-2,3-dimethylimidazolium tetrafluoroborate?

The IUPAC name is 1-ethyl-2,3-dimethylimidazol-3-ium;tetrafluoroborate.

What is the InChIKey of 1-ethyl-2,3-dimethylimidazolium tetrafluoroborate?

The InChIKey is KNIWGPCMWBGRBE-UHFFFAOYSA-N.

What is the Canonical SMILES of 1-ethyl-2,3-dimethylimidazolium tetrafluoroborate?

The Canonical SMILES is [B-](F)(F)(F)F.CCN1C=C[N+](=C1C)C.

What is the molecular weight of 1-ethyl-2,3-dimethylimidazolium tetrafluoroborate?

The molecular weight is 212.00 g/mol.

How many hydrogen bond donor counts does 1-ethyl-2,3-dimethylimidazolium tetrafluoroborate have?

It has 0 hydrogen bond donor counts.

What is the hydrogen bond acceptor count of 1-ethyl-2,3-dimethylimidazolium tetrafluoroborate?

The hydrogen bond acceptor count is 5.

How many rotatable bond counts does 1-ethyl-2,3-dimethylimidazolium tetrafluoroborate have?

It has 1 rotatable bond count.

Is the compound canonicalized?

Yes, the compound is canonicalized.