Isopropylboronic Acid

Product Information

Molecular Formula:
C3H9O2B
Molecular Weight:
87.91
Description
Reactant or reagent involved in: Copper-promoted cross-coupling; Domino Heck-Suzuki reactions; C-H activation for arylations and alkylations; Suzuki-Miyaura type couple reactions; Alkylation-hydride reduction sequence.
Synonyms
propan-2-ylboronic acid; propan-2-ylboronic acid
IUPAC Name
propan-2-ylboronic acid
Canonical SMILES
B(C(C)C)(O)O
InChI
InChI=1S/C3H9BO2/c1-3(2)4(5)6/h3,5-6H,1-2H3
InChI Key
QIPHSSYCQCBJAX-UHFFFAOYSA-N
Boiling Point
160.4 °C at 760 mmHg
Melting Point
95-100 °C (lit.)
Flash Point
Not applicable
Purity
≥ 95 %
Density
0.921 g/cm3
LogP
-0.13080

Safety Information

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
2
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
1
Exact Mass
88.0695597 g/mol
Monoisotopic Mass
88.0695597 g/mol
Topological Polar Surface Area
40.5Ų
Heavy Atom Count
6
Formal Charge
0
Complexity
35.8
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
KR-102352929-B1 Organic metal compound, organic light emitting diode and organic light emitting device having the compound 2020-10-23
JP-2021006572-A Aminonaphthoquinone compounds, and pharmaceutical compositions for blocking the ubiquitination-proteasome system in disease 2020-10-05
CN-112028879-A Electron transport material, organic electroluminescent device and display device 2020-09-29
CN-112079729-A Preparation method of 3-alkyl-5-trifluoromethylaniline 2020-09-22
WO-2022028321-A1 Nitroxoline derivative, preparation method therefor, and use thereof 2020-08-03
JP-2022021687-A Method for Producing N-Substituted (Meta) Acrylamide 2020-07-22
WO-2022003712-A1 Quinazolinones derivatives for treatment of non-alcoholic fatty liver disease, preparation and use thereof 2020-06-29
CN-113248532-A Organic compound, organic photoelectric element containing organic compound and application 2020-05-30
WO-2021241490-A1 Nanoparticles of cerium oxide, dispersion including nanoparticles of cerium oxide, oxidizing agent, antiviral agent, and antibacterial agent 2020-05-25
CN-113491691-A Compound for preparing antitumor drugs or 14-3-3 eta protein inhibitors 2020-04-02
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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