3-Benzyloxy-5-fluorobenzeneboronic acid

• CAS: 850589-56-9
• Catalog Number: ACM850589569
• Category: Boronic Acids
• Molecular Weight: 246.04
• Molecular Formula: C₁₃H₁₂O₃BF
• Synonyms: 3-BENZYLOXY-5-FLUOROPHENYLBORONIC ACID, 850589-56-9, SBB065888, AG-H-41346, 3-Benzyloxy-5-fluorobenzeneboronic acid, ACMC-209q3e, SureCN2504564, CTK5F4011, MolPort-001-772-790, ANW-38088, AKOS015839312, AB30757, RL05256, 3-Benzyloxy-5-fluorophenylboronic acid,, 3-(benzyloxy)-5-fluorophenylboronic acid, AK-40447, KB-29934, (3-fluoro-5-phenylmethoxyphenyl)boronic acid, FT-0652280, V1866
• IUPAC Name: (3-fluoro-5-phenylmethoxyphenyl)boronic acid
• SMILES: B(C1=CC(=CC(=C1)F)OCC2=CC=CC=C2)(O)O
• InChI Key: QQOFKMPPQQMUDH-UHFFFAOYSA-N
• Boiling Point: 418.1ºC at 760 mmHg
• Melting Point: 156-162ºC
• Flash Point: 206.7ºC
• Density: 1.26g/cm³
• Exact Mass: 246.08600
• Hazard Statements: Xi: Irritant
• H-Bond Acceptor: 4
• H-Bond Donor: 2

Custom Q&A

What is the molecular formula of 3-Benzyloxy-5-fluorobenzeneboronic acid?

The molecular formula of 3-Benzyloxy-5-fluorobenzeneboronic acid is C13H12BFO3.

What is the molecular weight of 3-Benzyloxy-5-fluorobenzeneboronic acid?

The molecular weight of 3-Benzyloxy-5-fluorobenzeneboronic acid is 246.04 g/mol.

What is the IUPAC name of 3-Benzyloxy-5-fluorobenzeneboronic acid?

The IUPAC name of 3-Benzyloxy-5-fluorobenzeneboronic acid is (3-fluoro-5-phenylmethoxyphenyl)boronic acid.

What is the InChI of 3-Benzyloxy-5-fluorobenzeneboronic acid?

The InChI of 3-Benzyloxy-5-fluorobenzeneboronic acid is InChI=1S/C13H12BFO3/c15-12-6-11(14(16)17)7-13(8-12)18-9-10-4-2-1-3-5-10/h1-8,16-17H,9H2.

What is the InChIKey of 3-Benzyloxy-5-fluorobenzeneboronic acid?

The InChIKey of 3-Benzyloxy-5-fluorobenzeneboronic acid is QQOFKMPPQQMUDH-UHFFFAOYSA-N.

What is the Canonical SMILES of 3-Benzyloxy-5-fluorobenzeneboronic acid?

The Canonical SMILES of 3-Benzyloxy-5-fluorobenzeneboronic acid is B(C1=CC(=CC(=C1)F)OCC2=CC=CC=C2)(O)O.

What is the CAS number of 3-Benzyloxy-5-fluorobenzeneboronic acid?

The CAS number of 3-Benzyloxy-5-fluorobenzeneboronic acid is 850589-56-9.

What is the European Community (EC) number of 3-Benzyloxy-5-fluorobenzeneboronic acid?

The European Community (EC) number of 3-Benzyloxy-5-fluorobenzeneboronic acid is 831-873-3.

What is the DSSTox Substance ID of 3-Benzyloxy-5-fluorobenzeneboronic acid?

The DSSTox Substance ID of 3-Benzyloxy-5-fluorobenzeneboronic acid is DTXSID40659379.

Is 3-Benzyloxy-5-fluorobenzeneboronic acid a canonicalized compound?

Yes, 3-Benzyloxy-5-fluorobenzeneboronic acid is a canonicalized compound according to PubChem.