2-Ethylphenylboronic acid

• CAS: 90002-36-1
• Catalog Number: ACM90002361
• Category: Boronic Acids
• Molecular Weight: 149.98g/mol
• Molecular Formula: C8H11BO2
• Synonyms: 2-ETHYLPHENYLBORONIC ACID;2-ETHYLBENZENEBORONIC ACID;AKOS BRN-0241;O-ETHYLPHENYLBORONIC ACID;2-Ethylbenzeneboronic acid, 98+%;2-Ethylphenylboronic Acid (contains varying amounts of Anhydride);boronic acid, (2-ethylphenyl)-;2-ETHYLPHENYLBORONIC
• IUPAC Name: (2-ethylphenyl)boronic acid
• SMILES: B(C1=CC=CC=C1CC)(O)O
• InChI: InChI=1S/C8H11BO2/c1-2-7-5-3-4-6-8(7)9(10)11/h3-6,10-11H,2H2,1H3
• InChI Key: QSSPYZOSTJDTTL-UHFFFAOYSA-N
• Complexity: 117
• Covalently-Bonded Unit Count: 1
• Exact Mass: 150.08521g/mol
• Formal Charge: 0
• H-Bond Acceptor: 2
• H-Bond Donor: 2
• Heavy Atom Count: 11
• Monoisotopic Mass: 150.08521g/mol
• Rotatable Bond Count: 2

Custom Q&A

What is the IUPAC name of the compound?

The IUPAC name of the compound is (2-ethylphenyl)boronic acid.

What is the molecular formula of the compound?

The molecular formula of the compound is C8H11BO2.

What is the molecular weight of the compound?

The molecular weight of the compound is 149.98 g/mol.

What is the CAS number of the compound?

The CAS number of the compound is 90002-36-1.

How many hydrogen bond donor counts are there in the compound?

There are 2 hydrogen bond donor counts in the compound.

How many hydrogen bond acceptor counts are there in the compound?

There are 2 hydrogen bond acceptor counts in the compound.

How many rotatable bond counts are there in the compound?

There are 2 rotatable bond counts in the compound.

What is the exact mass of the compound?

The exact mass of the compound is 150.0852098 g/mol.

What is the topological polar surface area of the compound?

The topological polar surface area of the compound is 40.5Ų.

How many heavy atoms are present in the compound?

There are 11 heavy atoms present in the compound.