1-Bromo-2-(difluoromethoxy)benzene

• CAS: 175278-33-8
• Catalog Number: ACM175278338
• Category: Bromine Series

Custom Q&A

What is the IUPAC name of the compound?

The IUPAC name of the compound is 1-bromo-2-(difluoromethoxy)benzene.

What is the molecular formula of the compound?

The molecular formula of the compound is C7H5BrF2O.

What is the molecular weight of the compound?

The molecular weight of the compound is 223.01 g/mol.

What is the CAS number of the compound?

The CAS number of the compound is 175278-33-8.

How many hydrogen bond donor counts does the compound have?

The compound has 0 hydrogen bond donor counts.

How many hydrogen bond acceptor counts does the compound have?

The compound has 3 hydrogen bond acceptor counts.

How many rotatable bond counts does the compound have?

The compound has 2 rotatable bond counts.

What is the topological polar surface area of the compound?

The topological polar surface area of the compound is 9.2 Ų.

How many heavy atoms does the compound have?

The compound has 11 heavy atoms.

Is the compound canonicalized?

Yes, the compound is canonicalized.

Synthetic Use

Upstream Synthesis Route 1

• 95-56-7
• 384-67-8

• 175278-33-8

Reference: [1] Journal of Organic Chemistry, 2006, vol. 71, # 26, p. 9845 - 9848

Downstream Synthesis Route 1

• 175278-33-8
• 73183-34-3

• 960067-33-8

Reference: [1] Patent: US2018/208604, 2018, A1, . Location in patent: Paragraph 0216-0217

Downstream Synthesis Route 2

• 175278-33-8
• 25015-63-8

• 960067-33-8

Reference: [1] European Journal of Medicinal Chemistry, 2016, vol. 124, p. 583 - 607

Downstream Synthesis Route 3

• 175278-33-8
• 89466-07-9

• 1259026-50-0

Reference: [1]Location in patent: experimental part
Parks, Daniel J.; Parsons, William H.; Colburn, Raymond W.; Meegalla, Sanath K.; Ballentine, Shelley K.; Illig, Carl R.; Qin, Ning; Liu, Yi; Hutchinson, Tasha L.; Lubin, Mary Lou; Stone, Dennis J.; Baker, Judith F.; Schneider, Craig R.; Ma, Jianya; Damiano, Bruce P.; Flores, Christopher M.; Player, Mark R.
[Journal of Medicinal Chemistry, 2011, vol. 54, # 1, p. 233 - 247]

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