(3-(Naphthalen-1-yl)phenyl)boronic acid

Basic Information

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CAS Number

881913-20-8

Molecular Formula

C16H13BO2

Molecular Weight

248.09 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Hydrocarbons

Basic Physical Properties

Boiling Point

471.9℃ at 760 mmHg

SMILES

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B(C1=CC(=CC=C1)C2=CC=CC3=CC=CC=C32)(O)O

InChI

InChI=1S/C16H13BO2/c18-17(19)14-8-3-7-13(11-14)16-10-4-6-12-5-1-2-9-15(12)16/h1-11,18-19H

InChIKey

HFXYUCJLQZCNPD-UHFFFAOYSA-N

LogP

2.1866

Topological Polar Surface Area

40.46 Å²

Hydrogen Bond Donor/Acceptor

2 / 2

Complexity

295

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Synonyms & References

English

(3-(Naphthalen-1-yl)phenyl)boronic acid
(3-naphthalen-1-ylphenyl)boronic acid
3-(Naphthalen-1-yl)phenylboronic acid
Boronic acid, [3-(1-naphthalenyl)phenyl]-
3-(1-Naphthyl)benzeneboronic Acid (contains varying amounts of Anhydride)
3-(1-naphthyl)phenylboronic acid
3-(1-Naphthyl)benzeneboronic acid
[3-(Naphthalen-1-yl)phenyl]boronic acid
HFXYUCJLQZCNPD-UHFFFAOYSA-N
3-(1-naphthyl) phenylboronic acid
4060AC
[3-(1-Naphthyl)phenyl]boronic acid
PB22452
(3-Naphthalen-1-ylphenyl)bo
[3-(naphthalen-1-yl)phenyl]boronic acid
B-[3-(1-Naphthalenyl)phenyl]boronic acid (ACI)
Boronic acid, [3-(1-naphthalenyl)phenyl]- (9CI)
DTXSID10730482
BORONIC ACID, [3-(1-NAPHTHALENYL)PHENYL]-
BORONIC ACID,[3-(1-NAPHTHALENYL)PHENYL]-
CS-W001000
(3-(Naphthalen-1-yl)phenyl)boronicacid
AKOS016003520
3-(NAPHTHALEN-1-YL)PHENYLBORONIC ACID
DS-15396
(3-(Naphthalen-1-yl)phenyl)boronic acid;3-(1-naphthalenyl)phenylboronic acid
MFCD11045054
SY037995
881913-20-8
(3-Naphthalen-1-ylphenyl)boronic acid
N1131

MDL Number

MFCD11045054

FAQ

What are the physical and chemical properties of (3-(Naphthalen-1-yl)phenyl)boronic acid (CAS: 881913-20-8)?

(3-(Naphthalen-1-yl)phenyl)boronic acid (CAS: 881913-20-8) is a crystalline solid with a molecular weight of approximately 276.27 g/mol. It has low solubility in water but is more soluble in organic solvents like dimethylformamide (DMF). This compound exhibits moderate reactivity, especially under basic conditions. It is often used in Suzuki coupling reactions due to its boronic acid functionality.

How is (3-(Naphthalen-1-yl)phenyl)boronic acid (CAS: 881913-20-8) typically synthesized?

(3-(Naphthalen-1-yl)phenyl)boronic acid (CAS: 881913-20-8) can be synthesized through a boronic acid formation reaction. Specifically, the reaction involves the coupling of 1-naphthylboronic acid with 3-phenylboronic acid in the presence of a Lewis acid catalyst such as tin(II) chloride (SnCl2) and a base like sodium carbonate (Na2CO3). The yield is typically around 70-80%, with good selectivity for the desired product.

What industries use (3-(Naphthalen-1-yl)phenyl)boronic acid (CAS: 881913-20-8)?

(3-(Naphthalen-1-yl)phenyl)boronic acid (CAS: 881913-20-8) is predominantly used in the pharmaceutical and polymer industries. It serves as a key reactant in the synthesis of various drugs and also finds application in the production of functional polymers. Additionally, it can be utilized in the development of sensors and semiconductors due to its unique chemical properties.

What precautions should be taken when handling (3-(Naphthalen-1-yl)phenyl)boronic acid (CAS: 881913-20-8)?

When handling (3-(Naphthalen-1-yl)phenyl)boronic acid (CAS: 881913-20-8), it is essential to use proper personal protective equipment (PPE) such as gloves and safety goggles. It should be stored in a cool, dry place away from strong acids and bases. In case of a spill, immediately clean up with appropriate absorbents and ensure the area is well-ventilated. Safety data sheets (SDS) should be consulted for detailed handling instructions.