4-Ethoxy-3-methylbenzeneboronic acid

• Catalog Number: ACM850568080
• Product Name: 4-Ethoxy-3-methylbenzeneboronic acid
• CAS: 850568-08-0
• Category: Boronic Acids
• Synonyms: 4-ETHOXY-3-METHYLPHENYLBORONIC ACID, 850568-08-0, 4-Ethoxy-3-methylbenzeneboronic acid, SBB071095, (4-ethoxy-3-methylphenyl)boronic acid, AG-H-41243, (4-ethoxy-3-methyl-phenyl)boronic Acid, AC1MOGD4, SureCN3659031, ACMC-209q18, CTK5F3939, MolPort-000-931-726, ANW-38010, 4-Ethoxy-3-methylphenylboronic acid,, AKOS004113855, AB26516, RL05247, AK-42654, KB-38513, N306
• IUPAC Name: (4-ethoxy-3-methylphenyl)boronic acid
• Molecular Weight: 180.01
• Molecular Formula: C9H13BO3
• Canonical SMILES: B(C1=CC(=C(C=C1)OCC)C)(O)O
• InChI Key: GAFSYSHEDOIUSI-UHFFFAOYSA-N
• Boiling Point: 333.1ºC at 760 mmHg
• Melting Point: 168-172ºC
• Flash Point: 155.2ºC
• Density: 1.11g/cm³
• Exact Mass: 180.09600
• Hazard Statements: Xi: Irritant
• H-Bond Acceptor: 3
• H-Bond Donor: 2

Custom Q&A

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

The molecular formula is C9H13BO3.

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

The molecular weight is 180.01 g/mol.

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

The IUPAC name is (4-ethoxy-3-methylphenyl)boronic acid.

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

The InChI is InChI=1S/C9H13BO3/c1-3-13-9-5-4-8(10(11)12)6-7(9)2/h4-6,11-12H,3H2,1-2H3.

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

The InChIKey is GAFSYSHEDOIUSI-UHFFFAOYSA-N.

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

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

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

The CAS number is 850568-08-0.

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

The EC number is 694-915-8.

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

The DSSTox Substance ID is DTXSID10391633.

Is 4-Ethoxy-3-methylbenzeneboronic acid a canonical compound?

Yes, 4-Ethoxy-3-methylbenzeneboronic acid is a canonical compound according to PubChem.