3-(Trimethylsilyl)phenylboronic Acid

Product Information

Molecular Formula:
C9H15O2BSi
Molecular Weight:
194.11
Description
3-(Trimethylsilyl)phenylboronic acid can be used: To prepare a 2-phenylpyridine ligand, which is used in the synthesis of Ir(III) complex applicable in the OLEDs; As an intermediate in the preparation of biphenyl derived amino acids; As a starting material for the synthesis of triphenylene-based electron transport materials.
Synonyms
(3-trimethylsilylphenyl)boronic acid; (3-trimethylsilylphenyl)boronic acid
IUPAC Name
(3-trimethylsilylphenyl)boronic acid
Canonical SMILES
B(C1=CC(=CC=C1)[Si](C)(C)C)(O)O
InChI
InChI=1S/C9H15BO2Si/c1-13(2,3)9-6-4-5-8(7-9)10(11)12/h4-7,11-12H,1-3H3
InChI Key
REMKRZLFPLDTKR-UHFFFAOYSA-N
Boiling Point
290.2 °C at 760 mmHg
Melting Point
145-150 °C (lit.)
Purity
≥ 95.0 %
Density
1.01 g/cm3
Appearance
White powder
LogP
-0.08840

Safety Information

Precautionary Statement
P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362
Signal Word
Warning

Computed Properties

Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
2
Exact Mass
194.0934364 g/mol
Monoisotopic Mass
194.0934364 g/mol
Topological Polar Surface Area
40.5Ų
Heavy Atom Count
13
Formal Charge
0
Complexity
168
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-111848668-A Pyridinylamino IVB group binuclear metal complex and preparation and application thereof 2020-08-05
CN-113299983-A Gel electrolyte, lithium ion battery and preparation method 2020-02-24
WO-2020239999-A1 SMALL MOLECULE INHIBITORS OF NF-kB INDUCING KINASE 2019-05-31
TW-202110842-A Small molecule inhibitors of nf-κb inducing kinase 2019-05-31
US-2021300918-A1 SMALL MOLECULE INHIBITORS OF NF-kB INDUCING KINASE 2019-05-31
AU-2020282005-A1 Small molecule inhibitors of NF-kB inducing kinase 2019-05-31
CA-3143350-A1 Small molecule inhibitors of nf-kb inducing kinase 2019-05-31
US-11254673-B2 Small molecule inhibitors of NF-κB inducing kinase 2019-05-31
EP-3498703-A1 Organic molecules for use in optoelectronic devices 2017-12-12
EP-3498703-B1 Organic molecules for use in optoelectronic devices 2017-12-12
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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