3-Quinolineboronic acid

• Catalog Number: ACM191162397
• Product Name: 3-Quinolineboronic acid
• CAS: 191162-39-7
• Category: Boronic Acids
• IUPAC Name: quinolin-3-ylboronic acid
• Molecular Weight: 172.98g/mol
• Molecular Formula: C9H8BNO2
• Canonical SMILES: B(C1=CC2=CC=CC=C2N=C1)(O)O
• InChI: InChI=1S/C9H8BNO2/c12-10(13)8-5-7-3-1-2-4-9(7)11-6-8/h1-6,12-13H
• InChI Key: YGDICLRMNDWZAK-UHFFFAOYSA-N
• Complexity: 177
• Covalently-Bonded Unit Count: 1
• Exact Mass: 173.064809g/mol
• Formal Charge: 0
• H-Bond Acceptor: 3
• H-Bond Donor: 2
• Heavy Atom Count: 13
• Monoisotopic Mass: 173.064809g/mol
• Rotatable Bond Count: 1

Custom Q&A

What is the PubChem CID of 3-quinolineboronic acid?

PubChem CID 2734663

What is the molecular formula of 3-quinolineboronic acid?

The molecular formula is C9H8BNO2.

What is the molecular weight of 3-quinolineboronic acid?

The molecular weight is 172.98 g/mol.

What is the IUPAC name of 3-quinolineboronic acid?

The IUPAC name is quinolin-3-ylboronic acid.

What is the InChI of 3-quinolineboronic acid?

The InChI is InChI=1S/C9H8BNO2/c12-10(13)8-5-7-3-1-2-4-9(7)11-6-8/h1-6,12-13H.

What is the InChIKey of 3-quinolineboronic acid?

The InChIKey is YGDICLRMNDWZAK-UHFFFAOYSA-N.

What is the canonical SMILES of 3-quinolineboronic acid?

The canonical SMILES is B(C1=CC2=CC=CC=C2N=C1)(O)O.

What is the CAS number of 3-quinolineboronic acid?

The CAS number is 191162-39-7.

What is the EC number of 3-quinolineboronic acid?

The EC number is 640-162-5.

Is 3-quinolineboronic acid a canonicalized compound?

Yes, 3-quinolineboronic acid is canonicalized.