2-Methoxy-1-naphthaleneboronic acid

Inquiry

Molecular Formula:

C11H11BO3

Molecular Weight:

202.01

CAS Number:

104116-17-8

Catalog Number:

104116-17-8

Product Information

Molecular Formula:

C11H11BO3

Molecular Weight:

202.01

Description

Reactant for:• Design of phosphorus C,P-ligands for environmentally benign cross-coupling reactions• Sterically hindered Suzuki-Miyaura coupling• Palladium-catalyzed cross-coupling reactions• Deboronation homocoupling reactions• Copper-catalyzed N-arylation of imidazoles• Stereoselective preparation of biaryl compounds via palladium-catalyzed asymmetric Suzuki-Miyaura coupling

Synonyms

(2-methoxynaphthalen-1-yl)boronicacid; 104116-17-8; (2-methoxynaphthalen-1-yl)boronicAcid; 2-METHOXY-1-NAPHTHALENEBORONICACID; 2-METHOXYNAPHTHALENE-1-BORONICACID; 1-(2-Methoxynaphthyl)boronicacid

IUPAC Name

(2-methoxynaphthalen-1-yl)boronic acid

Canonical SMILES

B(C1=C(C=CC2=CC=CC=C12)OC)(O)O

InChI

InChI=1S/C11H11BO3/c1-15-10-7-6-8-4-2-3-5-9(8)11(10)12(13)14/h2-7,13-14H,1H3

InChI Key

NHVWTZOWDLOBBS-UHFFFAOYSA-N

Melting Point

125-130 °C

Flash Point

Not applicable

Purity

95%

Safety Information

Hazards

H315 - H319 - H335

Precautionary Statement

P302 + P352 - P305 + P351 + P338

Computed Properties

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

202.0801244 g/mol

Monoisotopic Mass

202.0801244 g/mol

Topological Polar Surface Area

49.7Å²

Heavy Atom Count

Formal Charge

Complexity

210

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-114133400-A	Organic compound, and electronic element and electronic device using same	2021-05-31
CN-113801127-A	Oxa-thiaazulene derivatives and their use	2020-07-07
KR-102346943-B1	Bis phenyl pyrazine derivatives organic light emitting compound and organic electroluminescent device including the same	2020-04-10
KR-20210126810-A	Bis phenyl pyrazine derivatives organic light emitting compound and organic electroluminescent device including the same	2020-04-10
US-2021269434-A1	Tricyclic compounds as inhibitors of kras	2020-01-10
WO-2021142252-A1	Tricyclic compounds as inhibitors of kras	2020-01-10
KR-20210083509-A	Heterocyclic compound, organic light emitting device comprising same and composition for organic layer of organic light emitting device	2019-12-27
WO-2021132984-A1	Heterocyclic compound, organic light-emitting diode comprising same, and composition for organic layer of organic light-emitting diode	2019-12-27
KR-102334762-B1	Heterocyclic compound, organic light emitting device comprising same and composition for organic layer of organic light emitting device	2019-12-27
TW-202132287-A	Heterocyclic compound, organic light emitting device comprising the same and composition for organic material layer of organic light emitting device	2019-12-27

Literatures

PMID	Publication Date	Title	Journal
16092863	2005-08-18	Efficient stereochemical controllers in biaryl Suzuki coupling reactions: benzylic carbinols bearing in beta-position thioether, dimethylamino, or sulfoxide groups	Organic letters

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The dilution calculator equation

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