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4-(N,N-dimethylamino)phenylboronic acid, pinacol ester

4-(N,N-dimethylamino)phenylboronic acid, pinacol ester

Inquiry

Molecular Formula:

C14H22BNO2

Molecular Weight:

247.14

Product Information

Molecular Formula:

C14H22BNO2

Molecular Weight:

247.14

Description

4-(N,N-dimethylamino)phenylboronic acid, pinacol ester is a key intermediate in the synthesis of pharmaceutical drugs targeting various diseases and conditions such as cancer, diabetes, and inflammatory disorders.

Synonyms

N,N-dimethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline; 4-(n,n-dimethylamino)phenylboronic acid, pinacol ester; 4-(n,n-dimethylamino)phenylboronic acid pinacol ester; dimethyl[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]amine; 4-(Dimethylamino)phenylboronic Acid Pinacol Ester; 4-(n,n-dimethylamino)phenylboronic acid,pinacol ester; (4-(DIMETHYLAMINO)PHENYL)BORONIC ACID PINACOL ESTER; 4-(N,N-Dimethylamino)phenylboronic acid, pinacol ester; 2-[4-(Dimethylamino)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborole; Dimethyl[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan -2-yl)phenyl]amine

IUPAC Name

N,N-dimethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline

Canonical SMILES

B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C14H22BNO2/c1-13(2)14(3,4)18-15(17-13)11-7-9-12(10-8-11)16(5)6/h7-10H,1-6H3

InChI Key

DGMLJJIUOFKPKB-UHFFFAOYSA-N

Flash Point

Not applicable

Safety Information

Hazards

H317

Precautionary Statement

P280

Computed Properties

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

247.1743591 g/mol

Monoisotopic Mass

247.1743591 g/mol

Topological Polar Surface Area

21.7Å²

Heavy Atom Count

Formal Charge

Complexity

280

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-113004194-A	Circular polarization luminescent organic micro-nano crystal material and preparation method and application thereof	2021-03-09
WO-2021244609-A1	Compound having macrocyclic structure and use thereof	2020-06-04
CN-113549010-A	Preparation and application of compound with AMPK agonistic activity and prodrug thereof	2020-04-26
KR-102178181-B1	Novel hydrazone derivatives comprising aryl or heteroaryl group substituted at terminal amine and use thereof	2020-03-31
KR-20200076655-A	Novel hydrazone derivatives comprising aryl or heteroaryl group substituted at terminal amine and use thereof	2020-03-31
CN-111808057-A	Suzuki reaction using alpha-O-alkenylsulfone as electrophile and use thereof	2019-04-10
CN-111808089-A	Preparation method of drug eprogliflozin for treating diabetes or derivative thereof	2019-04-10
WO-2020130214-A1	Novel hydrazone derivative with aryl or heteroaryl group substituted at terminal amine group thereof and use thereof	2018-12-19
KR-20200076808-A	Novel hydrazone derivatives comprising aryl or heteroaryl group substituted at terminal amine and use thereof	2018-12-19
KR-102128509-B1	Novel hydrazone derivatives comprising aryl or heteroaryl group substituted at terminal amine and use thereof	2018-12-19

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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