8-Isoquinolinylboronic acid

Basic Information

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CAS Number

721401-43-0

Molecular Formula

C9H8BNO2

Molecular Weight

172.98 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Boiling Point

419.1°C at 760 mmHg

Density

1.28

Flash Point

207.3°C

Refractive Index

1.644

SMILES

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B(C1=C2C=NC=CC2=CC=C1)(O)O

InChI

InChI=1S/C9H8BNO2/c12-10(13)9-3-1-2-7-4-5-11-6-8(7)9/h1-6,12-13H

InChIKey

RKCMKNFWHLIGSF-UHFFFAOYSA-N

LogP

-0.08540000000000036

Topological Polar Surface Area

53.35 Å²

Hydrogen Bond Donor/Acceptor

2 / 3

Complexity

177

Synonyms & References

English

Isoquinoline-8-boronic acid
J-521581
RKCMKNFWHLIGSF-UHFFFAOYSA-N
ISOQUINOLIINE-8-BORONICACID
(isoquinolin-8-yl)boronic acid
721401-43-0
A9401
8-ISOQUINOLINYL-BORONIC ACID
Isoquinonline-8-boronic acid
DTXSID10657367
8-isoquinolinylboronic acid
8-ISOQUINOLINEBORONIC ACID
Isoquinolin-8-yl-8-boronic acid
BCP22430
SCHEMBL3788988
EN300-316584
BORONIC ACID, B-8-ISOQUINOLINYL-
8-isoquinolylboronic acid
isoquinolin-8-ylboronic acid
SY034801
SB38449
MFCD11044913
FT-0603962
AMY14896
Boronic acid,8-isoquinolinyl-
CS-B1264
PS-9420
AKOS015902142
8-Isoquinolineboronic acid
Isoquinolin-8-ylboronic acid
C9H8BNO2

MDL Number

MFCD11044913

FAQ

What regulatory guidelines apply to 8-Isoquinolinylboronic acid (CAS: 721401-43-0)?

8-Isoquinolinylboronic acid (CAS: 721401-43-0) is subject to various regulatory guidelines. Under the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), it should be classified and labeled appropriately based on its hazards. In Europe, it falls under the scope of REACH regulations, requiring registration if imported or manufactured in quantities above certain thresholds. The U.S. FDA and EPA have specific requirements for the handling and disposal of this compound, especially regarding its environmental impact and safe storage in laboratories.

Are there alternatives to 8-Isoquinolinylboronic acid (CAS: 721401-43-0) in synthesis?

Several alternatives to 8-Isoquinolinylboronic acid (CAS: 721401-43-0) are available for synthesis purposes. Common alternatives include other boronic acids such as phenylboronic acid or 2-methylphenylboronic acid. These alternatives can offer similar reactivity and can be used depending on the specific needs of the synthesis. It is important to consider the availability, cost, and compatibility of these alternatives with the overall reaction conditions.

What is the market or research trend for 8-Isoquinolinylboronic acid (CAS: 721401-43-0)?

The market for 8-Isoquinolinylboronic acid (CAS: 721401-43-0) is growing due to its applications in various fields such as medicinal chemistry and materials science. Research trends indicate increasing interest in the compound's use as a building block for drug discovery and development. There is also a trend towards exploring its applications in organic synthesis and as a catalyst precursor. Market demand is expected to remain strong, driven by the expanding scope of its utility in academic and industrial research.

How should waste containing 8-Isoquinolinylboronic acid (CAS: 721401-43-0) be handled?

Waste containing 8-Isoquinolinylboronic acid (CAS: 721401-43-0) should be handled carefully to ensure environmental safety and compliance with regulations. Waste liquid should be collected in appropriate containers and stored in a fume hood or a well-ventilated area. For solid waste, it should be disposed of through professional waste disposal services. Environmental protection precautions include ensuring no leakage into the environment and proper labeling of all waste containers. It is crucial to follow local waste disposal regulations for safe and responsible waste management.