trans-5-Chloro-1-penten-1-ylboronic acid pinacol ester

Product Information

Molecular Formula:
C11H20BClO2
Molecular Weight:
230.54
Description
trans-5-Chloro-1-penten-1-ylboronic acid pinacol ester is a boronic acid pinacol ester utilized in the biomedicine industry. It has potential applications in targeted drug delivery systems for treating specific diseases.
Synonyms
(E)-5-Chloro-1-penteneboronic acid pinacol ester, E-2-(5-Chloro-pent-1-enyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane, trans-2-(5-Chloro-
IUPAC Name
2-[(E)-5-chloropent-1-enyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Canonical SMILES
B1(OC(C(O1)(C)C)(C)C)C=CCCCCl
InChI
InChI=1S/C11H20BClO2/c1-10(2)11(3,4)15-12(14-10)8-6-5-7-9-13/h6,8H,5,7,9H2,1-4H3/b8-6+
InChI Key
FYHBHADHHWPOFL-SOFGYWHQSA-N
Flash Point
230.0 °F
Purity
97%
Density
1.004 g/mL at 25 °C
Refractive Index
n20/D 1.4630

Computed Properties

Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
4
Exact Mass
230.1244877 g/mol
Monoisotopic Mass
230.1244877 g/mol
Topological Polar Surface Area
18.5Ų
Heavy Atom Count
15
Formal Charge
0
Complexity
223
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
1
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)

The dilution calculator equation

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

This equation is commonly abbreviated as: C1V1 = C2V2

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