2-Fluoro-5-(trifluoromethyl)phenylboronic acid

• CAS: 352535-96-7
• Catalog Number: ACM352535967
• Category: Other Products
• Molecular Weight: 207.92g/mol
• Molecular Formula: C7H5BF4O2
• Synonyms: 2-FLUORO-5-(TRIFLUOROMETHYL)BENZENEBORONIC ACID;2-FLUORO-5-(TRIFLUOROMETHYL)BORONIC ACID;2-FLUORO-5-(TRIFLUOROMETHYL)PHENYLBORONIC ACID;AKOS BRN-0988;2-FLUORO-5-(TRIFLUOROMETHYL)PHENYLBORON&;2-FLUOROPYRIDINE-5-(TRIFLUOROMERHYL)PHENYLBORONIC ACID;Boronic a
• IUPAC Name: [2-fluoro-5-(trifluoromethyl)phenyl]boronic acid
• Canonical SMILES: B(C1=C(C=CC(=C1)C(F)(F)F)F)(O)O
• InChI: InChI=1S/C7H5BF4O2/c9-6-2-1-4(7(10,11)12)3-5(6)8(13)14/h1-3,13-14H
• InChI Key: KUHVVLFCTMTYGR-UHFFFAOYSA-N
• Complexity: 197
• Covalently-Bonded Unit Count: 1
• Exact Mass: 208.031872g/mol
• Formal Charge: 0
• H-Bond Acceptor: 6
• H-Bond Donor: 2
• Heavy Atom Count: 14
• Monoisotopic Mass: 208.031872g/mol
• Rotatable Bond Count: 1

Custom Q&A

What is the molecular formula of 2-Fluoro-5-(trifluoromethyl)phenylboronic acid?

The molecular formula is C7H5BF4O2.

When was 2-Fluoro-5-(trifluoromethyl)phenylboronic acid first created?

It was first created on July 19, 2005.

What is the IUPAC name of 2-Fluoro-5-(trifluoromethyl)phenylboronic acid?

The IUPAC name is [2-fluoro-5-(trifluoromethyl)phenyl]boronic acid.

What is the InChIKey of 2-Fluoro-5-(trifluoromethyl)phenylboronic acid?

The InChIKey is KUHVVLFCTMTYGR-UHFFFAOYSA-N.

What is the canonical SMILES representation of 2-Fluoro-5-(trifluoromethyl)phenylboronic acid?

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

How many hydrogen bond donor counts does 2-Fluoro-5-(trifluoromethyl)phenylboronic acid have?

It has 2 hydrogen bond donor counts.

What is the exact mass of 2-Fluoro-5-(trifluoromethyl)phenylboronic acid?

The exact mass is 208.0318722 g/mol.

How many topological polar surface areas does 2-Fluoro-5-(trifluoromethyl)phenylboronic acid have?

It has a topological polar surface area of 40.5 Ų.

How many heavy atoms are present in the compound of 2-Fluoro-5-(trifluoromethyl)phenylboronic acid?

There are 14 heavy atoms in the compound.

Is the compound of 2-Fluoro-5-(trifluoromethyl)phenylboronic acid canonicalized?

Yes, the compound is canonicalized.