5-Fluoro-6-methoxypyridine-3-boronic acid

• CAS: 856250-60-7
• Catalog Number: ACM856250607
• Category: Boronic Acids
• Molecular Weight: 170.94g/mol
• Molecular Formula: C6H7BFNO3
• IUPAC Name: (5-fluoro-6-methoxypyridin-3-yl)boronic acid
• SMILES: B(C1=CC(=C(N=C1)OC)F)(O)O
• InChI: InChI=1S/C6H7BFNO3/c1-12-6-5(8)2-4(3-9-6)7(10)11/h2-3,10-11H,1H3
• InChI Key: OCWTXKZPAZAQQW-UHFFFAOYSA-N
• Complexity: 149
• Covalently-Bonded Unit Count: 1
• Exact Mass: 171.050301g/mol
• Formal Charge: 0
• H-Bond Acceptor: 5
• H-Bond Donor: 2
• Heavy Atom Count: 12
• Monoisotopic Mass: 171.050301g/mol
• Rotatable Bond Count: 2

Custom Q&A

What is the molecular formula of 5-Fluoro-6-methoxypyridine-3-boronic acid?

The molecular formula is C6H7BFNO3.

What is the molecular weight of 5-Fluoro-6-methoxypyridine-3-boronic acid?

The molecular weight is 170.94 g/mol.

What is the IUPAC name of 5-Fluoro-6-methoxypyridine-3-boronic acid?

The IUPAC name is (5-fluoro-6-methoxypyridin-3-yl)boronic acid.

What is the InChI of 5-Fluoro-6-methoxypyridine-3-boronic acid?

The InChI is InChI=1S/C6H7BFNO3/c1-12-6-5(8)2-4(3-9-6)7(10)11/h2-3,10-11H,1H3.

What is the InChIKey of 5-Fluoro-6-methoxypyridine-3-boronic acid?

The InChIKey is OCWTXKZPAZAQQW-UHFFFAOYSA-N.

What is the canonical SMILES of 5-Fluoro-6-methoxypyridine-3-boronic acid?

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

What is the CAS number of 5-Fluoro-6-methoxypyridine-3-boronic acid?

The CAS number is 856250-60-7.

What is the European Community (EC) number of 5-Fluoro-6-methoxypyridine-3-boronic acid?

The EC number is 835-884-4.

What is the molecular weight, hydrogen bond donor count, and hydrogen bond acceptor count of 5-Fluoro-6-methoxypyridine-3-boronic acid?

The molecular weight is 170.94 g/mol, the hydrogen bond donor count is 2, and the hydrogen bond acceptor count is 5.

Is 5-Fluoro-6-methoxypyridine-3-boronic acid a canonicalized compound?

Yes, it is a canonicalized compound according to PubChem.