4-Butylphenylboronic acid

• Catalog Number: ACM145240284
• Product Name: 4-Butylphenylboronic acid
• CAS: 145240-28-4
• Category: Boronic Acids
• Synonyms: 4-BUTYLPHENYLBORONIC ACID;4-N-BUTYLPHENYLBORONIC ACID;4-N-BUTYLBENZENEBORONIC ACID;AKOS BRN-0152;4-N-Butylphenylboronic;4-butylbenzeneboronic acid;4-Butylphenylboronic Acid (contains varying amounts of Anhydride);4-Butylphenylboronic
• IUPAC Name: (4-butylphenyl)boronic acid
• Molecular Weight: 178.04g/mol
• Molecular Formula: C10H15BO2
• Canonical SMILES: B(C1=CC=C(C=C1)CCCC)(O)O
• InChI: InChI=1S/C10H15BO2/c1-2-3-4-9-5-7-10(8-6-9)11(12)13/h5-8,12-13H,2-4H2,1H3
• InChI Key: UGZUUTHZEATQAM-UHFFFAOYSA-N
• Complexity: 131
• Covalently-Bonded Unit Count: 1
• Exact Mass: 178.11651g/mol
• Formal Charge: 0
• H-Bond Acceptor: 2
• H-Bond Donor: 2
• Heavy Atom Count: 13
• Monoisotopic Mass: 178.11651g/mol
• Rotatable Bond Count: 4

Custom Q&A

What is the molecular formula of 4-Butylphenylboronic acid?

The molecular formula of 4-Butylphenylboronic acid is C10H15BO2.

What is the molecular weight of 4-Butylphenylboronic acid?

The molecular weight of 4-Butylphenylboronic acid is 178.04 g/mol.

What is the IUPAC name of 4-Butylphenylboronic acid?

The IUPAC name of 4-Butylphenylboronic acid is (4-butylphenyl)boronic acid.

What is the InChI of 4-Butylphenylboronic acid?

The InChI of 4-Butylphenylboronic acid is InChI=1S/C10H15BO2/c1-2-3-4-9-5-7-10(8-6-9)11(12)13/h5-8,12-13H,2-4H2,1H3.

What is the InChIKey of 4-Butylphenylboronic acid?

The InChIKey of 4-Butylphenylboronic acid is UGZUUTHZEATQAM-UHFFFAOYSA-N.

What is the canonical SMILES of 4-Butylphenylboronic acid?

The canonical SMILES of 4-Butylphenylboronic acid is B(C1=CC=C(C=C1)CCCC)(O)O.

What is the CAS number of 4-Butylphenylboronic acid?

The CAS number of 4-Butylphenylboronic acid is 145240-28-4.

How many hydrogen bond donor count does 4-Butylphenylboronic acid have?

4-Butylphenylboronic acid has 2 hydrogen bond donor count.

How many hydrogen bond acceptor count does 4-Butylphenylboronic acid have?

4-Butylphenylboronic acid has 2 hydrogen bond acceptor count.

What is the topological polar surface area of 4-Butylphenylboronic acid?

The topological polar surface area of 4-Butylphenylboronic acid is 40.5Ų.