Phenylboronic acid MIDA ester

Inquiry

Molecular Formula:

C11H12BNO4

Molecular Weight:

233.03

CAS Number:

109737-57-7

Catalog Number:

109737-57-7

Product Information

Molecular Formula:

C11H12BNO4

Molecular Weight:

233.03

Description

Suzuki Cross-Coupling with MIDA Boronates
Excludes solvent of crystallization. May containup to 10 wt. % DMSO.

Synonyms

6-Methyl-2-phenyl-1,3,6,2-dioxazaborocane-4,8-dione

IUPAC Name

6-methyl-2-phenyl-1,3,6,2-dioxazaborocane-4,8-dione

Canonical SMILES

B1(OC(=O)CN(CC(=O)O1)C)C2=CC=CC=C2

InChI

InChI=1S/C11H12BNO4/c1-13-7-10(14)16-12(17-11(15)8-13)9-5-3-2-4-6-9/h2-6H,7-8H2,1H3

InChI Key

AISHCGVNWMRLOM-UHFFFAOYSA-N

Melting Point

166-170 °C

Flash Point

Not applicable

Purity

95%

Safety Information

Hazards

H301

Precautionary Statement

P301 + P310

Computed Properties

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

233.0859380 g/mol

Monoisotopic Mass

233.0859380 g/mol

Topological Polar Surface Area

55.8Å²

Heavy Atom Count

Formal Charge

Complexity

284

Isotope Atom Count

Defined Atom Stereocenter Count

Undefined Atom Stereocenter Count

Defined Bond Stereocenter Count

Undefined Bond Stereocenter Count

Covalently-Bonded Unit Count

Compound Is Canonicalized

Yes

Patents

Publication Number	Title	Priority Date
CN-105359324-A	Lithium secondary battery electrolyte and lithium secondary battery comprising same	2013-12-19
CN-105359324-B	Lithium secondary cell electrolyte and the lithium secondary battery comprising it	2013-12-19
KR-102100244-B1	Electrolyte for Lithium Secondary Battery and Lithium Secondary Battery Containing the Same	2013-12-19
KR-20150072046-A	Electrolyte for Lithium Secondary Battery and Lithium Secondary Battery Containing the Same	2013-12-19
US-10243235-B2	Lithium secondary battery electrolyte and lithium secondary battery comprising same	2013-12-19
US-2017033403-A1	Lithium Secondary Battery Electrolyte and Lithium Secondary Battery Comprising Same	2013-12-19
WO-2015093885-A1	Lithium secondary battery electrolyte and lithium secondary battery comprising same	2013-12-19
EP-2914598-B1	Hepatitis c virus inhibitors	2012-11-02
US-2015329547-A1	Hepatitis C Virus Inhibitors	2012-11-02
US-9334279-B2	Hepatitis C virus inhibitors	2012-11-02

The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

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The dilution calculator equation

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This equation is commonly abbreviated as: C₁V₁ = C₂V₂

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