5-Trifluoromethylpyridine-3-boronicacid

• CAS: 947533-51-9
• Catalog Number: ACM947533519
• Category: Boro-Amino Acids
• Molecular Weight: 190.92
• Molecular Formula: C₆H₅BF₃NO₂
• Synonyms: 947533-51-9, 3-Trifluoromethylpyridine-5-boronic acid, 5-Trifluoromethyl-pyridine-3-boronic acid, 3-Borono-5-(trifluoromethyl)pyridine, 5-Trifluoromethylpyridine-3-boronic acid, 5-(trifluoromethyl)pyridin-3-ylboronic acid, [5-(trifluoromethyl)-3-pyridinyl]boronic acid, 3-TRIFLUOROMETHYL-5-PYRIDYL BORONIC ACID, [5-(TRIFLUOROMETHYL)-3-PYRIDYL]BORONIC ACID, (5-(Trifluoromethyl)pyridin-3-yl)boronic acid, [5-(trifluoromethyl)pyridin-3-yl]boronic acid, PubChem12812, ACMC-209rtp, SureCN27266, CTK5H7049, MolPort-004-969-063, ANW-40331, PC7177, AKOS006283523, AB55285
• IUPAC Name: [5-(trifluoromethyl)pyridin-3-yl]boronic acid
• Canonical SMILES: B(C1=CC(=CN=C1)C(F)(F)F)(O)O
• InChI Key: SFBQNNGMEKUJAN-UHFFFAOYSA-N
• Boiling Point: 299.9ºC at 760 mmHg
• Flash Point: 135.2ºC
• Density: 1.44 g/cm³
• Exact Mass: 191.03700
• H-Bond Acceptor: 6
• H-Bond Donor: 2

Custom Q&A

What is the molecular formula of 5-Trifluoromethylpyridine-3-boronic acid?

The molecular formula is C6H5BF3NO2.

What is the molecular weight of 5-Trifluoromethylpyridine-3-boronic acid?

The molecular weight is 190.92 g/mol.

What is the IUPAC name of 5-Trifluoromethylpyridine-3-boronic acid?

The IUPAC name is [5-(trifluoromethyl)pyridin-3-yl]boronic acid.

What is the InChI of 5-Trifluoromethylpyridine-3-boronic acid?

The InChI is InChI=1S/C6H5BF3NO2/c8-6(9,10)4-1-5(7(12)13)3-11-2-4/h1-3,12-13H.

What is the InChIKey of 5-Trifluoromethylpyridine-3-boronic acid?

The InChIKey is SFBQNNGMEKUJAN-UHFFFAOYSA-N.

What is the Canonical SMILES of 5-Trifluoromethylpyridine-3-boronic acid?

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

What is the CAS number of 5-Trifluoromethylpyridine-3-boronic acid?

The CAS number is 947533-51-9.

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

The EC number is 816-370-9.

What is the Nikkaji Number of 5-Trifluoromethylpyridine-3-boronic acid?

The Nikkaji Number is J2.731.960B.

Is 5-Trifluoromethylpyridine-3-boronic acid a canonicalized compound?

Yes, 5-Trifluoromethylpyridine-3-boronic acid is considered a canonicalized compound.