2-Methoxycarbonylphenylboronic acid

• CAS: 374538-03-1
• Catalog Number: ACM374538031
• Category: Boronic Acids
• Molecular Weight: 179.97g/mol
• Molecular Formula: C8H9BO4
• Synonyms: METHYL 2-BORONOBENZOATE;2-(METHOXYCARBONYL)BENZENEBORONIC ACID;2-METHOXYCARBONYLPHENYLBORONIC ACID;O-(METHOXYCARBONYL)PHENYLBORONIC ACID;Benzoic acid, 2-borono-, 1-methyl ester (9CI);2-Carbomethoxybenzeneboronicacid;2-(Methoxycarbonyl)Phenylboron;2-(Metho
• IUPAC Name: (2-methoxycarbonylphenyl)boronic acid
• Canonical SMILES: B(C1=CC=CC=C1C(=O)OC)(O)O
• InChI: InChI=1S/C8H9BO4/c1-13-8(10)6-4-2-3-5-7(6)9(11)12/h2-5,11-12H,1H3
• InChI Key: ODAXNYMENLFYMY-UHFFFAOYSA-N
• Complexity: 183
• Covalently-Bonded Unit Count: 1
• Exact Mass: 180.059389g/mol
• Formal Charge: 0
• H-Bond Acceptor: 4
• H-Bond Donor: 2
• Heavy Atom Count: 13
• Monoisotopic Mass: 180.059389g/mol
• Rotatable Bond Count: 3

Custom Q&A

What is the molecular formula of 2-Methoxycarbonylphenylboronic acid?

The molecular formula of 2-Methoxycarbonylphenylboronic acid is C8H9BO4.

What is the molecular weight of 2-Methoxycarbonylphenylboronic acid?

The molecular weight of 2-Methoxycarbonylphenylboronic acid is 179.97 g/mol.

What is the IUPAC name of 2-Methoxycarbonylphenylboronic acid?

The IUPAC name of 2-Methoxycarbonylphenylboronic acid is (2-methoxycarbonylphenyl)boronic acid.

What is the InChI of 2-Methoxycarbonylphenylboronic acid?

The InChI of 2-Methoxycarbonylphenylboronic acid is InChI=1S/C8H9BO4/c1-13-8(10)6-4-2-3-5-7(6)9(11)12/h2-5,11-12H,1H3.

What is the InChIKey of 2-Methoxycarbonylphenylboronic acid?

The InChIKey of 2-Methoxycarbonylphenylboronic acid is ODAXNYMENLFYMY-UHFFFAOYSA-N.

What is the canonical SMILES of 2-Methoxycarbonylphenylboronic acid?

The canonical SMILES of 2-Methoxycarbonylphenylboronic acid is B(C1=CC=CC=C1C(=O)OC)(O)O.

What is the CAS number of 2-Methoxycarbonylphenylboronic acid?

The CAS number of 2-Methoxycarbonylphenylboronic acid is 374538-03-1.

What is the European Community (EC) number of 2-Methoxycarbonylphenylboronic acid?

The European Community (EC) number of 2-Methoxycarbonylphenylboronic acid is 640-205-8.

What is the DSSTox Substance ID of 2-Methoxycarbonylphenylboronic acid?

The DSSTox Substance ID of 2-Methoxycarbonylphenylboronic acid is DTXSID40378497.

Are there any defined atom stereocenter counts in 2-Methoxycarbonylphenylboronic acid?

No, there are no defined atom stereocenter counts in 2-Methoxycarbonylphenylboronic acid.