2,4-Difluorophenylboronic Acid Pinacol Ester

Product Information

Molecular Formula:
C12H15F2O2B
Molecular Weight:
240.05
Description
2,4-Difluorophenylboronic Acid Pinacol Ester (CAS# 288101-48-4) is a useful research chemical.
Synonyms
2-(2,4-difluorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane; 2-(2,4-difluorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
IUPAC Name
2-(2,4-difluorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Canonical SMILES
B1(OC(C(O1)(C)C)(C)C)C2=C(C=C(C=C2)F)F
InChI
InChI=1S/C12H15BF2O2/c1-11(2)12(3,4)17-13(16-11)9-6-5-8(14)7-10(9)15/h5-7H,1-4H3
InChI Key
HVKAOYLQBVBZDU-UHFFFAOYSA-N
Boiling Point
276.5 °C at 760 mmHg
Melting Point
41-44 °C (lit.)
Flash Point
226.4 °F
Purity
97 %
Density
1.11 g/cm3
Solubility
Water : Insoluble
Storage
2-8 °C
LogP
2.26400

Safety Information

Hazards
H315 - H319 - H335
Precautionary Statement
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word
Warning

Computed Properties

Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
1
Exact Mass
240.1133162 g/mol
Monoisotopic Mass
240.1133162 g/mol
Topological Polar Surface Area
18.5Ų
Heavy Atom Count
17
Formal Charge
0
Complexity
280
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-110357832-B Preparation method of aromatic amine compound, EphB4 kinase inhibitor and derivatives thereof 2019-07-08
WO-2020212581-A1 N-acyl-{4-[(4-aryl-phenyl)sulfonylmethyl]piperidine} compounds and their therapeutic use 2019-04-18
AU-2020257561-A1 N-acyl-{4-((4-aryl-phenyl)sulfonylmethyl)piperidine} compounds and their therapeutic use 2019-04-18
CN-113766953-A N-acyl- {4- [ (4-aryl-phenyl) sulfonylmethyl ] piperidine } compounds and their therapeutic use 2019-04-18
EP-3956030-A1 N-acyl-{4-[(4-aryl-phenyl)sulfonylmethyl]piperidine} compounds and their therapeutic use 2019-04-18
KR-20220002871-A N-acyl-[4-[(4-aryl-phenyl)sulfonylmethyl]piperidine] compounds and their therapeutic uses 2019-04-18
WO-2020157201-A1 Oxadiazinone compounds for the treatment of hyperproliferative diseases 2019-02-01
WO-2020035560-A1 1-methyl-4-[(4-phenylphenyl)sulfonylmethyl]cyclohexyanol and 1-methyl-4-[[4-(2-pyridyl)phenyl]sulfonylmethyl]cyclohexanol compounds and their therapeutic use 2018-08-15
AU-2019322188-A1 1-methyl-4-[(4-phenylphenyl)sulfonylmethyl]cyclohexyanol and 1-methyl-4-[[4-(2-pyridyl)phenyl]sulfonylmethyl]cyclohexanol compounds and their therapeutic use 2018-08-15
BR-112021002647-A2 1-methyl-4-[(4-phenylphenyl)sulfonylmethyl]cyclohexianol and 1-methyl-4-[[4-(2-pyridyl)phenyl]sulfonylmethyl]cyclohexanol compounds and their therapeutic use 2018-08-15
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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