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Structure

3,4,5-Trifluorobenzyl bromide

CAS
220141-72-0
Catalog Number
ACM220141720
Category
Bromine Series
Molecular Weight
225.01

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Specification

Hazard Statements
H314
Symbol
GHS05
What is the molecular formula of 3,4,5-Trifluorobenzyl bromide?

The molecular formula of 3,4,5-Trifluorobenzyl bromide is C7H4BrF3.

What is the molecular weight of 3,4,5-Trifluorobenzyl bromide?

The molecular weight of 3,4,5-Trifluorobenzyl bromide is 225.01 g/mol.

What are the synonyms of 3,4,5-Trifluorobenzyl bromide?

Some synonyms of 3,4,5-Trifluorobenzyl bromide are 220141-72-0, 5-(Bromomethyl)-1,2,3-trifluorobenzene, and Benzene, 5-(bromomethyl)-1,2,3-trifluoro.

When was 3,4,5-Trifluorobenzyl bromide first created?

3,4,5-Trifluorobenzyl bromide was first created on July 19, 2005.

What is the InChIKey of 3,4,5-Trifluorobenzyl bromide?

The InChIKey of 3,4,5-Trifluorobenzyl bromide is MPEKZIYOLQCWLL-UHFFFAOYSA-N.

How many hydrogen bond acceptor counts does 3,4,5-Trifluorobenzyl bromide have?

3,4,5-Trifluorobenzyl bromide has 3 hydrogen bond acceptor counts.

What is the exact mass of 3,4,5-Trifluorobenzyl bromide?

The exact mass of 3,4,5-Trifluorobenzyl bromide is 223.94485 g/mol.

How many rotatable bond counts does 3,4,5-Trifluorobenzyl bromide have?

3,4,5-Trifluorobenzyl bromide has 1 rotatable bond count.

Is 3,4,5-Trifluorobenzyl bromide a canonicalized compound?

Yes, 3,4,5-Trifluorobenzyl bromide is a canonicalized compound.

What is the topological polar surface area of 3,4,5-Trifluorobenzyl bromide?

The topological polar surface area of 3,4,5-Trifluorobenzyl bromide is 0Ų.

Upstream Synthesis Route 1

  • 220227-37-2
  • 220141-72-0

Reference: [1] Journal of Physical Chemistry B, 2000, vol. 104, # 47, p. 11081 - 11087
[2] Patent: WO2007/14011, 2007, A2, . Location in patent: Page/Page column 91

Downstream Synthesis Route 1

  • 220141-72-0
  • 220228-03-5

Reference: [1] Patent: JP2015/61825, 2015, A, . Location in patent: Paragraph 0241

Downstream Synthesis Route 2

  • 220141-72-0
  • 10387-40-3
  • 873463-85-5

Reference: [1]Journal of Organic Chemistry,2018,vol. 83,p. 3529 - 3536
[2]Bioorganic and Medicinal Chemistry Letters,2008,vol. 18,p. 5146 - 5149
[3]Journal of Physical Chemistry B,2000,vol. 104,p. 11081 - 11087

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

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