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Structure

4-Fluoro-2-methylphenylboronic acid

CAS
139911-29-8
Catalog Number
ACM139911298
Category
Boronic Acids
Molecular Weight
153.95g/mol
Molecular Formula
C7H8BFO2

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Specification

Synonyms
4-FLUORO-2-METHYLPHENYLBORONIC ACID;4-FLUORO-2-METHYLBENZENEBORONIC ACID;4-FLUORO-O-TOLYLBORONIC ACID;AKOS BRN-0102;2-METHYL-4-FLUOROPHENYLBORONIC ACID;4-Fluoro-2-methylphenylboronic acid~4-Fluoro-o-tolylboronic acid;Boronic acid, (4-fluoro-2-methylphenyl
IUPAC Name
(4-fluoro-2-methylphenyl)boronic acid
Canonical SMILES
B(C1=C(C=C(C=C1)F)C)(O)O
InChI
InChI=1S/C7H8BFO2/c1-5-4-6(9)2-3-7(5)8(10)11/h2-4,10-11H,1H3
InChI Key
IQMLIVUHMSIOQP-UHFFFAOYSA-N
Complexity
132
Covalently-Bonded Unit Count
1
Exact Mass
154.060138g/mol
Formal Charge
0
H-Bond Acceptor
3
H-Bond Donor
2
Heavy Atom Count
11
Monoisotopic Mass
154.060138g/mol
Rotatable Bond Count
1
What is the PubChem CID of 4-Fluoro-2-methylphenylboronic acid?

The PubChem CID of 4-Fluoro-2-methylphenylboronic acid is 2734665.

What is the molecular formula of 4-Fluoro-2-methylphenylboronic acid?

The molecular formula of 4-Fluoro-2-methylphenylboronic acid is C7H8BFO2.

What is the molecular weight of 4-Fluoro-2-methylphenylboronic acid?

The molecular weight of 4-Fluoro-2-methylphenylboronic acid is 153.95 g/mol.

What is the IUPAC name of 4-Fluoro-2-methylphenylboronic acid?

The IUPAC name of 4-Fluoro-2-methylphenylboronic acid is (4-fluoro-2-methylphenyl)boronic acid.

What is the InChI of 4-Fluoro-2-methylphenylboronic acid?

The InChI of 4-Fluoro-2-methylphenylboronic acid is InChI=1S/C7H8BFO2/c1-5-4-6(9)2-3-7(5)8(10)11/h2-4,10-11H,1H3.

What is the InChIKey of 4-Fluoro-2-methylphenylboronic acid?

The InChIKey of 4-Fluoro-2-methylphenylboronic acid is IQMLIVUHMSIOQP-UHFFFAOYSA-N.

What is the Canonical SMILES of 4-Fluoro-2-methylphenylboronic acid?

The Canonical SMILES of 4-Fluoro-2-methylphenylboronic acid is B(C1=C(C=C(C=C1)F)C)(O)O.

What is the CAS number of 4-Fluoro-2-methylphenylboronic acid?

The CAS number of 4-Fluoro-2-methylphenylboronic acid is 139911-29-8.

How many hydrogen bond donor counts does 4-Fluoro-2-methylphenylboronic acid have?

4-Fluoro-2-methylphenylboronic acid has 2 hydrogen bond donor counts.

How many hydrogen bond acceptor counts does 4-Fluoro-2-methylphenylboronic acid have?

4-Fluoro-2-methylphenylboronic acid has 3 hydrogen bond acceptor counts.

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