3-Bromo-5-cyanobenzotrifluoride

• Catalog Number: ACMA00001734
• Category: Aryl Fluorinated Building Blocks
• Molecular Weight: 250.02
• Molecular Formula: C₁₄H₁₅FO₅
• Hazard Statements: H302
• RIDADR: UN 3439 6.1 / PGIII
• Symbol: GHS07

Custom Q&A

What is the molecular formula of 3-Bromo-5-cyanobenzotrifluoride?

The molecular formula of 3-Bromo-5-cyanobenzotrifluoride is C8H3BrF3N.

What is the molecular weight of 3-Bromo-5-cyanobenzotrifluoride?

The molecular weight of 3-Bromo-5-cyanobenzotrifluoride is 250.01 g/mol.

What is the IUPAC name of 3-Bromo-5-cyanobenzotrifluoride?

The IUPAC name of 3-Bromo-5-cyanobenzotrifluoride is 3-bromo-5-(trifluoromethyl)benzonitrile.

What is the InChIKey of 3-Bromo-5-cyanobenzotrifluoride?

The InChIKey of 3-Bromo-5-cyanobenzotrifluoride is KZFVJLGAVFCPAZ-UHFFFAOYSA-N.

What is the Canonical SMILES of 3-Bromo-5-cyanobenzotrifluoride?

The Canonical SMILES of 3-Bromo-5-cyanobenzotrifluoride is C1=C(C=C(C=C1C(F)(F)F)Br)C#N.

What is the CAS number of 3-Bromo-5-cyanobenzotrifluoride?

The CAS number of 3-Bromo-5-cyanobenzotrifluoride is 691877-03-9.

What is the XLogP3-AA value of 3-Bromo-5-cyanobenzotrifluoride?

The XLogP3-AA value of 3-Bromo-5-cyanobenzotrifluoride is 3.2.

How many hydrogen bond acceptors are in 3-Bromo-5-cyanobenzotrifluoride?

There are 4 hydrogen bond acceptors in 3-Bromo-5-cyanobenzotrifluoride.

What is the topological polar surface area of 3-Bromo-5-cyanobenzotrifluoride?

The topological polar surface area of 3-Bromo-5-cyanobenzotrifluoride is 23.8 A^2.

Is 3-Bromo-5-cyanobenzotrifluoride a canonicalized compound?

Yes, 3-Bromo-5-cyanobenzotrifluoride is a canonicalized compound.