4-Methyl-2-(1-pyrazolyl)phenylboronic Acid

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Product Information

Molecular Formula
C10H11N2O2B
Molecular Weight
202.02
Description
4-Methyl-2-(1-pyrazolyl)phenylboronic Acid (CAS# 1287753-43-8) is a useful research chemical.
Synonyms
[4-methyl-2-(1-pyrazolyl)phenyl]boronic acid; (4-methyl-2-pyrazol-1-ylphenyl)boronic acid
IUPAC Name
(4-methyl-2-pyrazol-1-ylphenyl)boronic acid
SMILES
B(C1=C(C=C(C=C1)C)N2C=CC=N2)(O)O
InChI
InChI=1S/C10H11BN2O2/c1-8-3-4-9(11(14)15)10(7-8)13-6-2-5-12-13/h2-7,14-15H,1H3
InChI Key
BFWQHIWBRDBMQI-UHFFFAOYSA-N
Flash Point
Not applicable
LogP
-0.13950

Computed Properties

Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
2
Exact Mass
202.0913578 g/mol
Monoisotopic Mass
202.0913578 g/mol
Topological Polar Surface Area
58.3Ų
Heavy Atom Count
15
Formal Charge
0
Complexity
216
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

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The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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