3-Methylphenylboronic acid

• CAS: 17933-03-8
• Catalog Number: ACM17933038
• Category: Boronic Acids
• Molecular Weight: 135.96g/mol
• Molecular Formula: C7H9BO2
• Synonyms: 3-TOLYBORONIC ACID;3-TOLYLBORONIC ACID;3-METHYLPHENYLBORONIC ACID;3-METHYLBENZENEBORONIC ACID;AKOS BRN-0018;RARECHEM AH PB 0229;M-TOLYLBORONIC ACID;M-METHYLPHENYLBORONIC ACID
• IUPAC Name: (3-methylphenyl)boronic acid
• Canonical SMILES: B(C1=CC(=CC=C1)C)(O)O
• InChI: InChI=1S/C7H9BO2/c1-6-3-2-4-7(5-6)8(9)10/h2-5,9-10H,1H3
• InChI Key: BJQCPCFFYBKRLM-UHFFFAOYSA-N
• Complexity: 106
• Covalently-Bonded Unit Count: 1
• Exact Mass: 136.06956g/mol
• Formal Charge: 0
• H-Bond Acceptor: 2
• H-Bond Donor: 2
• Heavy Atom Count: 10
• Monoisotopic Mass: 136.06956g/mol
• Rotatable Bond Count: 1

Custom Q&A

What is the PubChem CID for 3-Methylphenylboronic acid?

PubChem CID: 2733950

What is the molecular formula of 3-Methylphenylboronic acid?

Molecular Formula: C7H9BO2

What is the molecular weight of 3-Methylphenylboronic acid?

Molecular Weight: 135.96 g/mol

What is the IUPAC Name of 3-Methylphenylboronic acid?

IUPAC Name: (3-methylphenyl)boronic acid

What is the InChI of 3-Methylphenylboronic acid?

InChI: InChI=1S/C7H9BO2/c1-6-3-2-4-7(5-6)8(9)10/h2-5,9-10H,1H3

What is the InChIKey of 3-Methylphenylboronic acid?

InChIKey: BJQCPCFFYBKRLM-UHFFFAOYSA-N

What is the canonical SMILES of 3-Methylphenylboronic acid?

Canonical SMILES: B(C1=CC(=CC=C1)C)(O)O

What is the CAS number of 3-Methylphenylboronic acid?

CAS number: 17933-03-8

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

Hydrogen Bond Donor Count: 2

Is 3-Methylphenylboronic acid a canonicalized compound?

Yes, 3-Methylphenylboronic acid is canonicalized.