3-Fluoro-5-methoxycarbonylphenylboronic acid

• Catalog Number: ACM871329623
• Product Name: 3-Fluoro-5-methoxycarbonylphenylboronic acid
• CAS: 871329-62-3
• Category: Boronic Acids
• Synonyms: 871329-62-3, 3-Fluoro-5-methoxycarbonylphenylboronic acid, (3-fluoro-5-methoxycarbonylphenyl)boronic acid, (3-Fluoro-5-Methoxycarbonyl)Benzeneboronic Acid, ACMC-209qg6, KSC657S1F, CTK5F7912, MolPort-001-771-776, ANW-38548, PC1774, SBB092229, AKOS006344213, AB30683, AG-H-51474, METHYL 3-BORONO-5-FLUOROBENZOATE, AK-62023, KB-31899, FT-0644978, X1411, 3-Fluoro-5-methoxycarbonylphenylboronic acid,
• IUPAC Name: (3-fluoro-5-methoxycarbonylphenyl)boronic acid
• Molecular Weight: 197.96
• Molecular Formula: C8H8 B F O4
• Canonical SMILES: B(C1=CC(=CC(=C1)F)C(=O)OC)(O)O
• InChI Key: VKHJVASTGLPBBL-UHFFFAOYSA-N
• Boiling Point: 372.5ºC at 760 mmHg
• Melting Point: 138-142ºC
• Flash Point: 179.1ºC
• Density: 1.33g/cm³
• Exact Mass: 198.05000
• Hazard Statements: Xi: Irritant
• H-Bond Acceptor: 5
• H-Bond Donor: 2

Custom Q&A

What is the molecular formula of 3-Fluoro-5-methoxycarbonylphenylboronic acid?

The molecular formula is C8H8BFO4.

What is the molecular weight of 3-Fluoro-5-methoxycarbonylphenylboronic acid?

The molecular weight is 197.96 g/mol.

What is the IUPAC name of 3-Fluoro-5-methoxycarbonylphenylboronic acid?

The IUPAC name is (3-fluoro-5-methoxycarbonylphenyl)boronic acid.

What is the InChI of 3-Fluoro-5-methoxycarbonylphenylboronic acid?

The InChI is InChI=1S/C8H8BFO4/c1-14-8(11)5-2-6(9(12)13)4-7(10)3-5/h2-4,12-13H,1H3.

What is the InChIKey of 3-Fluoro-5-methoxycarbonylphenylboronic acid?

The InChIKey is VKHJVASTGLPBBL-UHFFFAOYSA-N.

What is the canonical SMILES of 3-Fluoro-5-methoxycarbonylphenylboronic acid?

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

What is the CAS number of 3-Fluoro-5-methoxycarbonylphenylboronic acid?

The CAS number is 871329-62-3.

What is the EC number of 3-Fluoro-5-methoxycarbonylphenylboronic acid?

The EC number is 801-967-9.

What is the DSSTox Substance ID of 3-Fluoro-5-methoxycarbonylphenylboronic acid?

The DSSTox Substance ID is DTXSID50660113.

Is 3-Fluoro-5-methoxycarbonylphenylboronic acid considered a canonical compound?

Yes, it is considered a canonical compound.