3-Aminophenylboronic acid

• CAS: 30418-59-8
• Catalog Number: ACM30418598
• Category: Boro-Amino Acids
• Molecular Weight: 136.95g/mol
• Molecular Formula: C6H8BNO2
• IUPAC Name: (3-aminophenyl)boronic acid
• Canonical SMILES: B(C1=CC(=CC=C1)N)(O)O
• InChI: InChI=1S/C6H8BNO2/c8-6-3-1-2-5(4-6)7(9)10/h1-4,9-10H,8H2
• InChI Key: JMZFEHDNIAQMNB-UHFFFAOYSA-N
• Complexity: 110
• Covalently-Bonded Unit Count: 1
• EC Number: 250-189-0
• Exact Mass: 137.064809g/mol
• Formal Charge: 0
• H-Bond Acceptor: 3
• H-Bond Donor: 3
• Heavy Atom Count: 10
• Monoisotopic Mass: 137.064809g/mol
• Rotatable Bond Count: 1

Custom Q&A

What is the molecular formula of 3-Aminophenylboronic acid?

The molecular formula of 3-Aminophenylboronic acid is C6H8BNO2.

What is the molecular weight of 3-Aminophenylboronic acid?

The molecular weight of 3-Aminophenylboronic acid is 136.95 g/mol.

What is the IUPAC name of 3-Aminophenylboronic acid?

The IUPAC name of 3-Aminophenylboronic acid is (3-aminophenyl)boronic acid.

What is the InChI of 3-Aminophenylboronic acid?

The InChI of 3-Aminophenylboronic acid is InChI=1S/C6H8BNO2/c8-6-3-1-2-5(4-6)7(9)10/h1-4,9-10H,8H2.

What is the InChIKey of 3-Aminophenylboronic acid?

The InChIKey of 3-Aminophenylboronic acid is JMZFEHDNIAQMNB-UHFFFAOYSA-N.

What is the canonical SMILES of 3-Aminophenylboronic acid?

The canonical SMILES of 3-Aminophenylboronic acid is B(C1=CC(=CC=C1)N)(O)O.

What is the CAS number of 3-Aminophenylboronic acid?

The CAS number of 3-Aminophenylboronic acid is 30418-59-8.

What is the European Community (EC) number of 3-Aminophenylboronic acid?

The European Community (EC) number of 3-Aminophenylboronic acid is 250-189-0.

What is the ChEMBL ID of 3-Aminophenylboronic acid?

The ChEMBL ID of 3-Aminophenylboronic acid is CHEMBL20852.

What is the hydrogen bond donor count of 3-Aminophenylboronic acid?

The hydrogen bond donor count of 3-Aminophenylboronic acid is 3.