4-Butoxy-3-chlorophenylboronic acid

• CAS: 480438-55-9
• Catalog Number: ACM480438559
• Category: Other Products; Boronic Acids
• Molecular Weight: 228.48g/mol
• Molecular Formula: C10H14BClO3
• IUPAC Name: (4-butoxy-3-chlorophenyl)boronic acid
• SMILES: B(C1=CC(=C(C=C1)OCCCC)Cl)(O)O
• InChI: InChI=1S/C10H14BClO3/c1-2-3-6-15-10-5-4-8(11(13)14)7-9(10)12/h4-5,7,13-14H,2-3,6H2,1H3
• InChI Key: AOKJNAVCTPBFPJ-UHFFFAOYSA-N
• Complexity: 180
• Covalently-Bonded Unit Count: 1
• Exact Mass: 228.072452g/mol
• Formal Charge: 0
• H-Bond Acceptor: 3
• H-Bond Donor: 2
• Heavy Atom Count: 15
• Monoisotopic Mass: 228.072452g/mol
• Rotatable Bond Count: 5

Custom Q&A

What is the molecular formula of 4-Butoxy-3-chlorophenylboronic acid?

The molecular formula is C10H14BClO3.

What is the molecular weight of 4-Butoxy-3-chlorophenylboronic acid?

The molecular weight is 228.48 g/mol.

When was 4-Butoxy-3-chlorophenylboronic acid created?

It was created on October 7, 2005.

When was 4-Butoxy-3-chlorophenylboronic acid last modified?

It was last modified on December 2, 2023.

What is the IUPAC name of 4-Butoxy-3-chlorophenylboronic acid?

The IUPAC name is (4-butoxy-3-chlorophenyl)boronic acid.

What is the InChI of 4-Butoxy-3-chlorophenylboronic acid?

The InChI is InChI=1S/C10H14BClO3/c1-2-3-6-15-10-5-4-8(11(13)14)7-9(10)12/h4-5,7,13-14H,2-3,6H2,1H3.

What is the InChIKey of 4-Butoxy-3-chlorophenylboronic acid?

The InChIKey is AOKJNAVCTPBFPJ-UHFFFAOYSA-N.

What is the canonical SMILES of 4-Butoxy-3-chlorophenylboronic acid?

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

What is the CAS number of 4-Butoxy-3-chlorophenylboronic acid?

The CAS number is 480438-55-9.

What is the hydrogen bond donor count of 4-Butoxy-3-chlorophenylboronic acid?

The hydrogen bond donor count is 2.