3-(Difluoromethoxy)aniline

• CAS: 22236-08-4
• Catalog Number: ACM22236084
• Category: Alkyl Fluorinated Building Blocks
• Molecular Weight: 159.13
• Molecular Formula: C₆H₁₂ClF₂N
• Hazard Statements: H302
• RIDADR: UN 2811 6.1 / PGIII
• Symbol: GHS07

Custom Q&A

What is the molecular formula of 3-(Difluoromethoxy)aniline?

The molecular formula is C7H7F2NO.

What is the molecular weight of 3-(Difluoromethoxy)aniline?

The molecular weight is 159.13 g/mol.

What is the IUPAC name of 3-(Difluoromethoxy)aniline?

The IUPAC name is 3-(difluoromethoxy)aniline.

What is the InChIKey of 3-(Difluoromethoxy)aniline?

The InChIKey is RSOFZRXRIPVBBM-UHFFFAOYSA-N.

How many hydrogen bond donor counts does 3-(Difluoromethoxy)aniline have?

It has 1 hydrogen bond donor count.

How many hydrogen bond acceptor counts does 3-(Difluoromethoxy)aniline have?

It has 4 hydrogen bond acceptor counts.

What is the topological polar surface area of 3-(Difluoromethoxy)aniline?

The topological polar surface area is 35.2 Ų.

How many rotatable bond counts does 3-(Difluoromethoxy)aniline have?

It has 2 rotatable bond counts.

What is the formal charge of 3-(Difluoromethoxy)aniline?

The formal charge is 0.

Is 3-(Difluoromethoxy)aniline a canonicalized compound?

Yes, it is a canonicalized compound.

Synthetic Use

Upstream Synthesis Route 1

• 39065-91-3

• 22236-08-4

Reference: [1] Tetrahedron Letters, 2009, vol. 50, # 4, p. 392 - 394

Downstream Synthesis Route 1

• 22236-08-4
• 118-91-2

• 51679-45-9

Reference: [1]Pharmaceutical Chemistry Journal,1973,vol. 7,p. 755 - 759
Khimiko-Farmatsevticheskii Zhurnal,1973,vol. 7,p. 15 - 19

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