3-Methoxyphenylboronic acid

• CAS: 10365-98-7
• Catalog Number: ACM10365987
• Category: Boronic Acids
• Molecular Weight: 151.96
• Molecular Formula: C7H9BO3
• Synonyms: 3-Methoxyphenylboronic
• IUPAC Name: (3-methoxyphenyl)boronic acid
• Canonical SMILES: B(C1=CC(=CC=C1)OC)(O)O
• InChI: InChI=1S/C7H9BO3/c1-11-7-4-2-3-6(5-7)8(9)10/h2-5,9-10H,1H3
• InChI Key: NLLGFYPSWCMUIV-UHFFFAOYSA-N
• Boiling Point: 318.6±44.0 °C
• Melting Point: 160-163 °C (lit.)
• Density: 1.17±0.1 g/ml
• Complexity: 118
• Covalently-Bonded Unit Count: 1
• Exact Mass: 152.064474g/mol
• Formal Charge: 0
• H-Bond Acceptor: 3
• H-Bond Donor: 2
• Heavy Atom Count: 11
• Monoisotopic Mass: 152.064474g/mol
• Rotatable Bond Count: 2

Custom Q&A

What is the PubChem CID for 3-Methoxyphenylboronic acid?

The PubChem CID for 3-Methoxyphenylboronic acid is 2734370.

What is the molecular formula of 3-Methoxyphenylboronic acid?

The molecular formula of 3-Methoxyphenylboronic acid is C7H9BO3.

What is the molecular weight of 3-Methoxyphenylboronic acid?

The molecular weight of 3-Methoxyphenylboronic acid is 151.96 g/mol.

What is the IUPAC name of 3-Methoxyphenylboronic acid?

The IUPAC name of 3-Methoxyphenylboronic acid is (3-methoxyphenyl)boronic acid.

What is the InChI of 3-Methoxyphenylboronic acid?

The InChI of 3-Methoxyphenylboronic acid is InChI=1S/C7H9BO3/c1-11-7-4-2-3-6(5-7)8(9)10/h2-5,9-10H,1H3.

What is the InChIKey of 3-Methoxyphenylboronic acid?

The InChIKey of 3-Methoxyphenylboronic acid is NLLGFYPSWCMUIV-UHFFFAOYSA-N.

What is the canonical SMILES of 3-Methoxyphenylboronic acid?

The canonical SMILES of 3-Methoxyphenylboronic acid is B(C1=CC(=CC=C1)OC)(O)O.

What is the CAS number of 3-Methoxyphenylboronic acid?

The CAS number of 3-Methoxyphenylboronic acid is 10365-98-7.

How many hydrogen bond donor counts does 3-Methoxyphenylboronic acid have?

3-Methoxyphenylboronic acid has 2 hydrogen bond donor counts.

How many hydrogen bond acceptor counts does 3-Methoxyphenylboronic acid have?

3-Methoxyphenylboronic acid has 3 hydrogen bond acceptor counts.

Synthetic Use

Downstream Synthesis Route 1

• 10365-98-7
• 106-95-6

• 24743-14-4

Reference: [1] Tetrahedron Letters, 2010, vol. 51, # 27, p. 3590 - 3592

Downstream Synthesis Route 2

• 10365-98-7
• 536-90-3

• 92248-06-1

Reference: [1] Patent: WO2007/79593, 2007, A1, . Location in patent: Page/Page column 31

Downstream Synthesis Route 3

• 10365-98-7

• 92248-06-1

Reference: [1] Chemistry Letters, 2009, vol. 38, # 7, p. 708 - 709

* For details of the synthesis route, please refer to the original source to ensure accuracy.