4-Ethoxy-3-trifluoromethylphenylboronic acid

• Catalog Number: ACM871329838
• Product Name: 4-Ethoxy-3-trifluoromethylphenylboronic acid
• CAS: 871329-83-8
• Category: Boronic Acids
• Synonyms: 871329-83-8, 4-ETHOXY-3-TRIFLUOROMETHYLPHENYLBORONIC ACID, 4-ETHOXY-3-(TRIFLUOROMETHYL)PHENYLBORONIC ACID, 3-Borono-6-ethoxybenzotrifluoride, SBB071261, AG-F-04361, 4-ETHOXY-3-(TRIFLUOROMETHYL)BENZENEBORONIC ACID, [4-ethoxy-3-(trifluoromethyl)phenyl]boronic acid, ACMC-209qgq, SureCN3113375, CTK4G6930, MolPort-001-771-775, ANW-38568, AKOS015838839, AB30773, AG-H-51495, RL05415, AK-45515, KB-38508, KB-191265
• IUPAC Name: [4-ethoxy-3-(trifluoromethyl)phenyl]boronic acid
• Molecular Weight: 233.98
• Molecular Formula: C9H10 B F3 O3
• Canonical SMILES: B(C1=CC(=C(C=C1)OCC)C(F)(F)F)(O)O
• InChI Key: SHCPXHBLEGXHIV-UHFFFAOYSA-N
• Boiling Point: 333.9ºC at 760 mmHg
• Flash Point: 155.8ºC
• Density: 1.31g/cm³
• Exact Mass: 234.06800
• Hazard Statements: Xi: Irritant
• H-Bond Acceptor: 6
• H-Bond Donor: 2

Custom Q&A

What is the molecular formula of 4-Ethoxy-3-trifluoromethylphenylboronic acid?

The molecular formula is C9H10BF3O3.

What is the molecular weight of 4-Ethoxy-3-trifluoromethylphenylboronic acid?

The molecular weight is 233.98 g/mol.

What is the IUPAC name of 4-Ethoxy-3-trifluoromethylphenylboronic acid?

The IUPAC name is [4-ethoxy-3-(trifluoromethyl)phenyl]boronic acid.

What is the InChI of 4-Ethoxy-3-trifluoromethylphenylboronic acid?

The InChI is InChI=1S/C9H10BF3O3/c1-2-16-8-4-3-6(10(14)15)5-7(8)9(11,12)13/h3-5,14-15H,2H2,1H3.

What is the InChIKey of 4-Ethoxy-3-trifluoromethylphenylboronic acid?

The InChIKey is SHCPXHBLEGXHIV-UHFFFAOYSA-N.

What is the canonical SMILES of 4-Ethoxy-3-trifluoromethylphenylboronic acid?

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

What is the CAS number of 4-Ethoxy-3-trifluoromethylphenylboronic acid?

The CAS number is 871329-83-8.

What is the European Community (EC) number of 4-Ethoxy-3-trifluoromethylphenylboronic acid?

The European Community (EC) number is 696-560-4.

What is the DSSTox Substance ID of 4-Ethoxy-3-trifluoromethylphenylboronic acid?

The DSSTox Substance ID is DTXSID00659395.

Is 4-Ethoxy-3-trifluoromethylphenylboronic acid a canonicalized compound?

Yes, 4-Ethoxy-3-trifluoromethylphenylboronic acid is a canonicalized compound.