1-benzyl-3-methylimidazolium bromide

• CAS: 65039-11-4
• Catalog Number: ACM65039114
• Category: Functionized Ionic Liquids
• Molecular Weight: 253.13
• Molecular Formula: C11H13N2Br
• Abbreviation: BzMIMBr
• Chemical Formula: BzMIMBr

Custom Q&A

What is the molecular formula of 1-benzyl-3-methylimidazolium bromide?

The molecular formula of 1-benzyl-3-methylimidazolium bromide is C11H13BrN2.

What is the molecular weight of 1-benzyl-3-methylimidazolium bromide?

The molecular weight of 1-benzyl-3-methylimidazolium bromide is 253.14 g/mol.

When was 1-benzyl-3-methylimidazolium bromide created and modified in PubChem?

1-benzyl-3-methylimidazolium bromide was created on 2007-02-08 and modified on 2023-12-30.

What is the IUPAC Name of 1-benzyl-3-methylimidazolium bromide?

The IUPAC Name of 1-benzyl-3-methylimidazolium bromide is 1-benzyl-3-methylimidazol-3-ium;bromide.

What is the InChIKey of 1-benzyl-3-methylimidazolium bromide?

The InChIKey of 1-benzyl-3-methylimidazolium bromide is VBLZTUCAWYJIMG-UHFFFAOYSA-M.

How many hydrogen bond donor counts does 1-benzyl-3-methylimidazolium bromide have?

1-benzyl-3-methylimidazolium bromide has 0 hydrogen bond donor counts.

What is the exact mass of 1-benzyl-3-methylimidazolium bromide?

The exact mass of 1-benzyl-3-methylimidazolium bromide is 252.02621 g/mol.

How many rotatable bond counts does 1-benzyl-3-methylimidazolium bromide have?

1-benzyl-3-methylimidazolium bromide has 2 rotatable bond counts.

What is the topological polar surface area of 1-benzyl-3-methylimidazolium bromide?

The topological polar surface area of 1-benzyl-3-methylimidazolium bromide is 8.8 Ų.

Is 1-benzyl-3-methylimidazolium bromide a canonicalized compound?

Yes, 1-benzyl-3-methylimidazolium bromide is a canonicalized compound.

Synthetic Use

Upstream Synthesis Route 1

• 616-47-7
• 100-39-0

• 65039-11-4

Reference: [1]Location in patent: experimental part
Asano, Keisuke; Matsubara, Seijiro
[Heterocycles, 2010, vol. 80, # 2, p. 989 - 1002]

Downstream Synthesis Route 1

• 65039-11-4

• 616-47-7
• 100-39-0

Reference: [1]Sarasin
[Helvetica Chimica Acta, 1923, vol. 6, p. 380]

Downstream Synthesis Route 2

• 65039-11-4

• 23269-08-1

Reference: [1]Tao, Xiao-Le; Lei, Ming; Wang, Yan-Guang
[Synthetic Communications, 2007, vol. 37, # 3, p. 399 - 408]

* For details of the synthesis route, please refer to the original source to ensure accuracy.