3-Fluoro-4-methylphenylboronic acid

• CAS: 168267-99-0
• Catalog Number: ACM168267990
• Category: Boronic Acids
• Molecular Weight: 153.95g/mol
• Molecular Formula: C7H8BFO2
• Synonyms: CHEMBRDG-BB 4003301;AKOS BRN-0218;3-FLUORO-4-METHYLBENZENEBORONIC ACID;3-FLUORO-4-METHYLPHENYLBORONIC ACID;3-FLUORO-P-TOLYLBORONIC ACID;3-Fluoro-4-methbenzene boronic acid;Boronic acid, (3-fluoro-4-methylphenyl)- (9CI);3-Fluoro-4-Methylphenylboronic
• IUPAC Name: (3-fluoro-4-methylphenyl)boronic acid
• Canonical SMILES: B(C1=CC(=C(C=C1)C)F)(O)O
• InChI: InChI=1S/C7H8BFO2/c1-5-2-3-6(8(10)11)4-7(5)9/h2-4,10-11H,1H3
• InChI Key: WPVBHUUZDFUIJA-UHFFFAOYSA-N
• Complexity: 132
• Covalently-Bonded Unit Count: 1
• Exact Mass: 154.060138g/mol
• Formal Charge: 0
• H-Bond Acceptor: 3
• H-Bond Donor: 2
• Heavy Atom Count: 11
• Monoisotopic Mass: 154.060138g/mol
• Rotatable Bond Count: 1

Custom Q&A

What is the PubChem CID of 3-Fluoro-4-methylphenylboronic acid?

PubChem CID 2782674.

What is the molecular formula of 3-Fluoro-4-methylphenylboronic acid?

The molecular formula is C7H8BFO2.

What is the molecular weight of 3-Fluoro-4-methylphenylboronic acid?

The molecular weight is 153.95 g/mol.

When was 3-Fluoro-4-methylphenylboronic acid created on PubChem?

It was created on July 19, 2005.

What is the IUPAC name of 3-Fluoro-4-methylphenylboronic acid?

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

What is the InChI of 3-Fluoro-4-methylphenylboronic acid?

The InChI is InChI=1S/C7H8BFO2/c1-5-2-3-6(8(10)11)4-7(5)9/h2-4,10-11H,1H3.

What is the InChIKey of 3-Fluoro-4-methylphenylboronic acid?

The InChIKey is WPVBHUUZDFUIJA-UHFFFAOYSA-N.

What is the canonical SMILES of 3-Fluoro-4-methylphenylboronic acid?

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

What is the CAS number of 3-Fluoro-4-methylphenylboronic acid?

The CAS number is 168267-99-0.

What is the European Community (EC) number of 3-Fluoro-4-methylphenylboronic acid?

The European Community (EC) number is 677-535-7.