5-Chloro-2-formylphenylboronic acid

• CAS: 870238-36-1
• Catalog Number: ACM870238361
• Category: Boronic Acids
• Molecular Weight: 184.39g/mol
• Molecular Formula: C7H6BClO3
• IUPAC Name: (5-chloro-2-formylphenyl)boronic acid
• SMILES: B(C1=C(C=CC(=C1)Cl)C=O)(O)O
• InChI: InChI=1S/C7H6BClO3/c9-6-2-1-5(4-10)7(3-6)8(11)12/h1-4,11-12H
• InChI Key: LVNPJTSTUBPCMK-UHFFFAOYSA-N
• Complexity: 165
• Covalently-Bonded Unit Count: 1
• Exact Mass: 184.009852g/mol
• Formal Charge: 0
• H-Bond Acceptor: 3
• H-Bond Donor: 2
• Heavy Atom Count: 12
• Monoisotopic Mass: 184.009852g/mol
• Rotatable Bond Count: 2

Custom Q&A

What is the molecular formula of 5-Chloro-2-formylphenylboronic acid?

The molecular formula is C7H6BClO3.

What is the molecular weight of 5-Chloro-2-formylphenylboronic acid?

The molecular weight is 184.39 g/mol.

What is the IUPAC Name of 5-Chloro-2-formylphenylboronic acid?

The IUPAC Name is (5-chloro-2-formylphenyl)boronic acid.

What is the InChI of 5-Chloro-2-formylphenylboronic acid?

The InChI is InChI=1S/C7H6BClO3/c9-6-2-1-5(4-10)7(3-6)8(11)12/h1-4,11-12H.

What is the InChIKey of 5-Chloro-2-formylphenylboronic acid?

The InChIKey is LVNPJTSTUBPCMK-UHFFFAOYSA-N.

What is the Canonical SMILES of 5-Chloro-2-formylphenylboronic acid?

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

What is the CAS number of 5-Chloro-2-formylphenylboronic acid?

The CAS number is 870238-36-1.

What is the EPA DSSTox Substance ID of 5-Chloro-2-formylphenylboronic acid?

The EPA DSSTox Substance ID is DTXSID30396701.

What is the Wikidata ID of 5-Chloro-2-formylphenylboronic acid?

The Wikidata ID is Q72451617.

What is the hydrogen bond donor count of 5-Chloro-2-formylphenylboronic acid?

The hydrogen bond donor count is 2.