(3-t-butyl-5-methylphenyl)boronic acid

Inquiry

Molecular Formula:

C11H17BO2

Molecular Weight:

192.06

Product Information

Molecular Formula:

C11H17BO2

Molecular Weight:

192.06

Description

(3-t-butyl-5-methylphenyl)boronic acid is an effective organoboronic acid compound in the biomedical industry. It’s used in the synthesis of diverse pharmaceutical substances, particularly in cancer treatment drugs through Suzuki-Miyaura cross-coupling reactions.

Synonyms

(3-(tert-Butyl)-5-methylphenyl)boronic acid; (3-tert-butyl-5-methylphenyl)boronic acid; 3-t-Butyl-5-methylphenylboronic acid; (3-T-BUTYL-5-METHYLPHENYL)BORONIC ACID; 3-(tert-Butyl)-5-methylbenzeneboronic acid; p-Methylphenacylamine; 3-tert-butyl-5-methylphenylboronic acid; 3-(tert-Butyl)-5-methylphenylboronic Acid; (3-(tert-Butyl)-5-methylphenyl)boronicacid; (3-t-butyl-5-methylphenyl)boronic acid; Boronic acid,[3-(1,1-dimethylethyl)-5-methylphenyl]-(9ci)

IUPAC Name

(3-tert-butyl-5-methylphenyl)boronic acid

Canonical SMILES

B(C1=CC(=CC(=C1)C(C)(C)C)C)(O)O

InChI

InChI=1S/C11H17BO2/c1-8-5-9(11(2,3)4)7-10(6-8)12(13)14/h5-7,13-14H,1-4H3

InChI Key

XWWPIVKWAIMBMU-UHFFFAOYSA-N

Flash Point

Not applicable

Safety Information

Hazards

H302 - H318

Precautionary Statement

P280 - P305 + P351 + P338

Computed Properties

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

192.1321599 g/mol

Monoisotopic Mass

192.1321599 g/mol

Topological Polar Surface Area

40.5Å²

Heavy Atom Count

Formal Charge

Complexity

186

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
WO-2022053905-A1	Organic metal complex, light-emitting device, light-emitting apparatus, electronic equipment, and lighting device	2020-09-11
CN-113105508-A	Organometallic complex, top-emission light-emitting material, light-emitting device, light-emitting apparatus, electronic device, and lighting apparatus	2020-01-10
DE-102020135111-A1	Organometallic complex, top emission light-emitting material, light-emitting device, light-emitting device, electronic device and lighting device	2020-01-10
KR-20210090555-A	Organometallic complex, light-emitting material for top emission, light-emitting device, light-emitting apparatus, electronic device, and lighting device	2020-01-10
US-2021214381-A1	Organometallic complex, light-emitting material for top emission, light-emitting device, light-emitting apparatus, electronic device, and lighting device	2020-01-10
JP-2021175719-A	Organometallic complexes, light emitting materials for top emissions, light emitting devices, light emitting devices, electronic devices and lighting devices	2020-01-10
TW-202132322-A	Organometallic complex, light-emitting material for top emission, light-emitting device, light-emitting apparatus, electronic device, and lighting device	2020-01-10
CN-111825721-A	Organometallic compound, and organic light emitting device and diagnostic composition including the same	2019-04-16
EP-3725793-A1	Organometallic compound, organic light-emitting device including the organometallic compound, and diagnostic composition including the organometallic compound	2019-04-16
KR-20200121655-A	Organometallic compound, organic light emitting device including the same and a composition for diagnosing including the same	2019-04-16

Literatures

PMID	Publication Date	Title	Journal
5780	1976-01-01	Microbial interactions in foods: meats, poultry and dairy products	Society for Applied Bacteriology symposium series

The molarity calculator equation

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

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The dilution calculator equation

Concentration _(start) × Volume _(start) = Concentration _(final) × Volume _(final)

This equation is commonly abbreviated as: C₁V₁ = C₂V₂

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