4-Chlorophenylboronic Acid Pinacol Ester

Product Information

Molecular Formula:
C12H16ClO2B
Molecular Weight:
238.52
Description
4-Chlorophenylboronic Acid Pinacol Ester (CAS# 195062-61-4) is a useful research chemical.
Synonyms
2-(4-chlorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane; 2-(4-chlorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
IUPAC Name
2-(4-chlorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Canonical SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)Cl
InChI
InChI=1S/C12H16BClO2/c1-11(2)12(3,4)16-13(15-11)9-5-7-10(14)8-6-9/h5-8H,1-4H3
InChI Key
NYARTXMDWRAVIX-UHFFFAOYSA-N
Boiling Point
308.7 °C at 760 mmHg
Melting Point
50-55 °C (lit.)
Flash Point
230.0 °F
Purity
97 %
Density
1.1 g/cm3
Appearance
Solid
Storage
2-8 °C
LogP
2.63920

Safety Information

Hazards
H302 - H413
Precautionary Statement
P264, P270, P273, P301+P312, P330, and P501
Signal Word
Warning

Computed Properties

Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
1
Exact Mass
238.0931876 g/mol
Monoisotopic Mass
238.0931876 g/mol
Topological Polar Surface Area
18.5Ų
Heavy Atom Count
16
Formal Charge
0
Complexity
244
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

Patents

Publication Number Title Priority Date
CN-113851599-A Organic electroluminescent device and display device comprising same 2021-09-13
CN-113725383-A Organic electroluminescent device and display device comprising same 2021-08-30
CN-111548269-A Preparation method of diarylmethane structure compound 2020-04-29
US-2021261587-A1 STRAD-binding agents and Uses Thereof 2020-01-30
CN-110627823-A Method for catalyzing arylamine to generate deamination boric acid esterification or halogenation 2019-10-17
CN-110627823-B Method for catalyzing arylamine to generate deamination boric acid esterification or halogenation 2019-10-17
EP-3764434-A1 Elimination of voltage-delays and stabilisation of impedance through electrolyte additives in alkaline metal chemical cells 2019-07-10
CN-110357832-B Preparation method of aromatic amine compound, EphB4 kinase inhibitor and derivatives thereof 2019-07-08
CN-109553535-A A kind of method that one kettle way prepares the chloro- 2`- nitrobiphenyl of 4- 2019-01-07
WO-2020132459-A1 Quinolinyl-pyrazine-carboxamide compounds and uses thereof 2018-12-20
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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