2-Methyl-2H-indazole-6-boronic acid

• CAS: 1001907-57-8
• Catalog Number: ACM1001907578
• Category: Boronic Acids
• Molecular Weight: 175.98g/mol
• Molecular Formula: C8H9BN2O2
• Synonyms: 2-METHYLINDAZOLE-6-BORONICACID;2-Methyl-2H-indazole-6-boronic acid
• IUPAC Name: (2-methylindazol-6-yl)boronic acid
• Canonical SMILES: B(C1=CC2=NN(C=C2C=C1)C)(O)O
• InChI: InChI=1S/C8H9BN2O2/c1-11-5-6-2-3-7(9(12)13)4-8(6)10-11/h2-5,12-13H,1H3
• InChI Key: JADBVQWCMHPPQA-UHFFFAOYSA-N
• Complexity: 191
• Covalently-Bonded Unit Count: 1
• Exact Mass: 176.075708g/mol
• Formal Charge: 0
• H-Bond Acceptor: 3
• H-Bond Donor: 2
• Heavy Atom Count: 13
• Monoisotopic Mass: 176.075708g/mol
• Rotatable Bond Count: 1

Custom Q&A

What is the molecular formula of 2-Methyl-2H-indazole-6-boronic acid?

The molecular formula is C8H9BN2O2.

What is the molecular weight of 2-Methyl-2H-indazole-6-boronic acid?

The molecular weight is 175.98 g/mol.

What is the IUPAC name of 2-Methyl-2H-indazole-6-boronic acid?

The IUPAC name is (2-methylindazol-6-yl)boronic acid.

What is the InChI code of 2-Methyl-2H-indazole-6-boronic acid?

The InChI code is InChI=1S/C8H9BN2O2/c1-11-5-6-2-3-7(9(12)13)4-8(6)10-11/h2-5,12-13H,1H3.

What is the InChIKey of 2-Methyl-2H-indazole-6-boronic acid?

The InChIKey is JADBVQWCMHPPQA-UHFFFAOYSA-N.

What is the canonical SMILES of 2-Methyl-2H-indazole-6-boronic acid?

The canonical SMILES is B(C1=CC2=NN(C=C2C=C1)C)(O)O.

What is the CAS number of 2-Methyl-2H-indazole-6-boronic acid?

The CAS number is 1001907-57-8.

What is the EC number of 2-Methyl-2H-indazole-6-boronic acid?

The EC number is 682-940-7.

What is the monoisotopic mass of 2-Methyl-2H-indazole-6-boronic acid?

The monoisotopic mass is 176.0757077 g/mol.

Is 2-Methyl-2H-indazole-6-boronic acid a canonicalized compound?

Yes, it is a canonicalized compound.