2,5-Difluorophenylboronic acid

• Catalog Number: ACM193353343
• Product Name: 2,5-Difluorophenylboronic acid
• CAS: 193353-34-3
• Category: Boronic Acids
• Synonyms: 2,5-FLUOROBENZENE BORONIC ACID;2,5-DIFLUOROBENZENEBORONIC ACID;2,5-DIFLUOROPHENYLBORONIC ACID;AKOS BRN-0301;RARECHEM AH PB 0165;2,5-Diflurorbenzene boronic acid;Boronic acid, (2,5-difluorophenyl)- (9CI);2,5-Difluorobenzeneboronic acid 98%
• IUPAC Name: (2,5-difluorophenyl)boronic acid
• Molecular Weight: 157.91g/mol
• Molecular Formula: C6H5BF2O2
• Canonical SMILES: B(C1=C(C=CC(=C1)F)F)(O)O
• InChI: InChI=1S/C6H5BF2O2/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3,10-11H
• InChI Key: KTOJGSDLJNUAEP-UHFFFAOYSA-N
• Complexity: 134
• Covalently-Bonded Unit Count: 1
• Exact Mass: 158.035066g/mol
• Formal Charge: 0
• H-Bond Acceptor: 4
• H-Bond Donor: 2
• Heavy Atom Count: 11
• Monoisotopic Mass: 158.035066g/mol
• Rotatable Bond Count: 1

Custom Q&A

What is the molecular formula of 2,5-Difluorophenylboronic acid?

The molecular formula is C6H5BF2O2.

What is the molecular weight of 2,5-Difluorophenylboronic acid?

The molecular weight is 157.91 g/mol.

What is the IUPAC name of 2,5-Difluorophenylboronic acid?

The IUPAC name is (2,5-difluorophenyl)boronic acid.

What is the InChI of 2,5-Difluorophenylboronic acid?

The InChI is InChI=1S/C6H5BF2O2/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3,10-11H.

What is the InChIKey of 2,5-Difluorophenylboronic acid?

The InChIKey is KTOJGSDLJNUAEP-UHFFFAOYSA-N.

What is the canonical SMILES of 2,5-Difluorophenylboronic acid?

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

What is the CAS number of 2,5-Difluorophenylboronic acid?

The CAS number is 193353-34-3.

What is the European Community (EC) number of 2,5-Difluorophenylboronic acid?

The EC number is 675-650-7.

What is the DSSTox Substance ID of 2,5-Difluorophenylboronic acid?

The DSSTox Substance ID is DTXSID10370226.

Is 2,5-Difluorophenylboronic acid a canonicalized compound?

Yes, it is a canonicalized compound.