3,5-Difluorobenzoyl chloride

• CAS: 129714-97-2
• Catalog Number: ACM129714972
• Category: Aryl Fluorinated Building Blocks
• Molecular Weight: 176.55
• Hazard Statements: H314
• RIDADR: UN 2920 3(8) / PGII
• Symbol: GHS05

Custom Q&A

What is the molecular formula of 3,5-Difluorobenzoyl chloride?

The molecular formula of 3,5-Difluorobenzoyl chloride is C7H3ClF2O.

What is the molecular weight of 3,5-Difluorobenzoyl chloride?

The molecular weight of 3,5-Difluorobenzoyl chloride is 176.55 g/mol.

What are some synonyms for 3,5-Difluorobenzoyl chloride?

Some synonyms for 3,5-Difluorobenzoyl chloride include 129714-97-2, Benzoyl chloride, 3,5-difluoro-, and 3,5-difluorobenzoylchloride.

When was 3,5-Difluorobenzoyl chloride first created?

3,5-Difluorobenzoyl chloride was first created on July 19, 2005.

What is the InChIKey for 3,5-Difluorobenzoyl chloride?

The InChIKey for 3,5-Difluorobenzoyl chloride is OYZWEOORLJBPMA-UHFFFAOYSA-N.

What is the XLogP3-AA value for 3,5-Difluorobenzoyl chloride?

The XLogP3-AA value for 3,5-Difluorobenzoyl chloride is 2.6.

How many hydrogen bond donor counts does 3,5-Difluorobenzoyl chloride have?

3,5-Difluorobenzoyl chloride has 0 hydrogen bond donor counts.

What is the topological polar surface area of 3,5-Difluorobenzoyl chloride?

The topological polar surface area of 3,5-Difluorobenzoyl chloride is 17.1 Å^2.

How many defined bond stereocenter counts does 3,5-Difluorobenzoyl chloride have?

3,5-Difluorobenzoyl chloride has 0 defined bond stereocenter counts.

Is 3,5-Difluorobenzoyl chloride canonicalized?

Yes, 3,5-Difluorobenzoyl chloride is canonicalized.

Synthetic Use

Upstream Synthesis Route 1

• 455-40-3

• 129714-97-2

Reference: [1]Patent: CN109574927,2019,A .Location in patent: Paragraph 0416; 0418-0421

Downstream Synthesis Route 1

• 126261-84-5
• 129714-97-2

• 2265-91-0
• 52710-27-7

Reference: [1] Nature Chemistry, 2018, vol. 10, # 10, p. 1016 - 1022

Downstream Synthesis Route 2

• 617-65-2
• 129714-97-2

• 104252-66-6

Reference: [1]Makovec; Chiste; Bani; et al.
[European Journal of Medicinal Chemistry, 1986, vol. 21, # 1, p. 9 - 20]

Downstream Synthesis Route 3

• 129714-97-2

• 132980-99-5

Reference: [1]Weikert; Bingham Jr.; Emanuel; Fraser-Smith; Loughhead; Nelson; Poulton
[Journal of Medicinal Chemistry, 1991, vol. 34, # 5, p. 1630 - 1633]
[2]Florvall, Lennart; Fagervall, Ingrid; Larsson, Lars-Gunnar; Ross, Svante B.
[European Journal of Medicinal Chemistry, 1999, vol. 34, # 2, p. 137 - 151]
[3]Hoque, Md Emdadul; Bisht, Ranjana; Unnikrishnan, Anju; Dey, Sayan; Mahamudul Hassan, Mirja Md; Guria, Saikat; Rai, Rama Nand; Sunoj, Raghavan B.; Chattopadhyay, Buddhadeb
[Angewandte Chemie - International Edition, 2022, vol. 61, # 27][Angew. Chem., 2022, vol. 134, # 27]

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