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Structure

2-Fluorophenylboronic acid

CAS
1993-03-9
Catalog Number
ACM1993039
Category
Other Products
Molecular Weight
139.92
Molecular Formula
C6H6BFO2

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Specification

Synonyms
Uorobenzeneboronic acid
IUPAC Name
(2-fluorophenyl)boronic acid
Canonical SMILES
B(C1=CC=CC=C1F)(O)O
InChI
InChI=1S/C6H6BFO2/c8-6-4-2-1-3-5(6)7(9)10/h1-4,9-10H
InChI Key
QCSLIRFWJPOENV-UHFFFAOYSA-N
Boiling Point
267.8±42.0 °C
Melting Point
101-110 °C (lit.)
Density
1.24±0.1 g/ml
Complexity
110
Covalently-Bonded Unit Count
1
Exact Mass
140.044488g/mol
Formal Charge
0
H-Bond Acceptor
3
H-Bond Donor
2
Heavy Atom Count
10
Monoisotopic Mass
140.044488g/mol
Rotatable Bond Count
1
What is the molecular formula of 2-Fluorophenylboronic acid?

The molecular formula of 2-Fluorophenylboronic acid is C6H6BFO2.

When was 2-Fluorophenylboronic acid first created and last modified?

2-Fluorophenylboronic acid was first created on July 19, 2005, and last modified on December 30, 2023.

What is the IUPAC name of 2-Fluorophenylboronic acid?

The IUPAC name of 2-Fluorophenylboronic acid is (2-fluorophenyl)boronic acid.

What is the Canonical SMILES of 2-Fluorophenylboronic acid?

The Canonical SMILES of 2-Fluorophenylboronic acid is B(C1=CC=CC=C1F)(O)O.

What is the CAS number of 2-Fluorophenylboronic acid?

The CAS number of 2-Fluorophenylboronic acid is 1993-03-9.

Is 2-Fluorophenylboronic acid a canonicalized compound?

Yes, 2-Fluorophenylboronic acid is a canonicalized compound.

How many hydrogen bond donor counts does 2-Fluorophenylboronic acid have?

2-Fluorophenylboronic acid has 2 hydrogen bond donor counts.

What is the topological polar surface area of 2-Fluorophenylboronic acid?

The topological polar surface area of 2-Fluorophenylboronic acid is 40.5?2.

How many heavy atoms make up 2-Fluorophenylboronic acid?

2-Fluorophenylboronic acid consists of 10 heavy atoms.

How many rotatable bond counts does 2-Fluorophenylboronic acid have?

2-Fluorophenylboronic acid has 1 rotatable bond count.

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