3-Fluoro-5-(trifluoromethyl)benzeneboronic acid

• CAS: 159020-59-4
• Catalog Number: ACM159020594
• Category: Main Products
• Molecular Weight: 207.9175
• Molecular Formula: C₇H₅BF₄O₂
• Synonyms: [3-fluoro-5-(trifluoromethyl)phenyl]boronic acid(SALTDATA: FREE);3-Fluoro-5-(trifluoromethyl)benzeneboronic acid 99%;3-Borono-5-fluorobenzotrifluoride;5-Fluoro-3-trifluoromethylbenzeneboronic acid
• IUPAC Name: [3-fluoro-5-(trifluoromethyl)phenyl]boronic acid
• Canonical SMILES: B(C1=CC(=CC(=C1)F)C(F)(F)F)(O)O
• InChI Key: WEMCWZGCSRGJGW-UHFFFAOYSA-N
• Boiling Point: 264ºC at 760mmHg
• Flash Point: 113.5ºC
• Density: 1.44g/cm³
• Exact Mass: 208.03200
• Hazard Statements: Xi:Irritant/KeepCold
• H-Bond Acceptor: 6
• H-Bond Donor: 2

Custom Q&A

What is the molecular formula of 3-Fluoro-5-(trifluoromethyl)benzeneboronic acid?

The molecular formula is C7H5BF4O2.

What is the molecular weight of 3-Fluoro-5-(trifluoromethyl)benzeneboronic acid?

The molecular weight is 207.92 g/mol.

What is the IUPAC name of 3-Fluoro-5-(trifluoromethyl)benzeneboronic acid?

The IUPAC name is [3-fluoro-5-(trifluoromethyl)phenyl]boronic acid.

What is the InChI of 3-Fluoro-5-(trifluoromethyl)benzeneboronic acid?

The InChI is InChI=1S/C7H5BF4O2/c9-6-2-4(7(10,11)12)1-5(3-6)8(13)14/h1-3,13-14H.

What is the InChIKey of 3-Fluoro-5-(trifluoromethyl)benzeneboronic acid?

The InChIKey is WEMCWZGCSRGJGW-UHFFFAOYSA-N.

What is the canonical SMILES of 3-Fluoro-5-(trifluoromethyl)benzeneboronic acid?

The canonical SMILES is B(C1=CC(=CC(=C1)F)C(F)(F)F)(O)O.

What is the CAS number of 3-Fluoro-5-(trifluoromethyl)benzeneboronic acid?

The CAS number is 159020-59-4.

What is the EC number of 3-Fluoro-5-(trifluoromethyl)benzeneboronic acid?

The EC number is 640-289-6.

How many hydrogen bond donor counts are there in 3-Fluoro-5-(trifluoromethyl)benzeneboronic acid?

There are 2 hydrogen bond donor counts.

How many hydrogen bond acceptor counts are there in 3-Fluoro-5-(trifluoromethyl)benzeneboronic acid?

There are 6 hydrogen bond acceptor counts.