1H-Pyrrol-2-ylboronic acid

Basic Information

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CAS Number

763120-43-0

Molecular Formula

C4H6BNO2

Molecular Weight

110.91 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

SMILES

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B(C1=CC=CN1)(O)O

InChI

InChI=1S/C4H6BNO2/c7-5(8)4-2-1-3-6-4/h1-3,6-8H

InChIKey

WADSQZHEAXPENM-UHFFFAOYSA-N

LogP

-1.3055

Topological Polar Surface Area

56.25 Å²

Hydrogen Bond Donor/Acceptor

3 / 3

Complexity

78.4

Synonyms & References

English

CS-0377022
Boronic acid, 1H-pyrrol-2-yl-
2-Pyrrolylboronic acid
SCHEMBL488858
1H-pyrrol-2-yl-2-boronic acid
MFCD03095055
AKOS006278865
(1H-pyrrol-2-yl)boronic acid
1H-pyrrol-2-ylboronic Acid
DTXSID80400625
PYRROLE-2-BORONIC ACID
2-Pyrrolylboronicacid
WADSQZHEAXPENM-UHFFFAOYSA-N
FT-0691108
AB13435
A838669
763120-43-0
1H-pyrrol-2-ylboronic acid
1H-pyrrole-2-boronic acid
2,6,6-TRIMETHYL-2-CYCLOHEXENE-1,4-DIONE
2-1H-pyrrolylboronic acid
PYRROL-2-YLBORONIC ACID
Boronicacid, 1H-pyrrol-2-yl- (9CI)
(Pyrrol-2-yl)boronic acid

MDL Number

MFCD03095055

Customs Code

2933990090

FAQ

What regulatory guidelines apply to 1H-Pyrrol-2-ylboronic acid (CAS: 763120-43-0)?

1H-Pyrrol-2-ylboronic acid (CAS: 763120-43-0) falls under the scope of REACH regulations for chemical substances in the European Union. It is also subject to the Global Harmonized System (GHS) for classification and labeling of chemicals. Additionally, the United States Environmental Protection Agency (EPA) and the Food and Drug Administration (FDA) have specific guidelines for handling and reporting of this compound in the United States.

Are there alternatives to 1H-Pyrrol-2-ylboronic acid (CAS: 763120-43-0) in synthesis?

Yes, there are several alternatives to 1H-Pyrrol-2-ylboronic acid (CAS: 763120-43-0) in synthetic chemistry, including pyrrole derivatives, boronic acids with different substituents, and other boron-containing compounds. Common alternative reagents include 1H-pyrrolylboronic acid and 1H-pyrrolylboronate esters, which can offer similar reactivity in various synthetic procedures.

What is the market or research trend for 1H-Pyrrol-2-ylboronic acid (CAS: 763120-43-0)?

The market for 1H-Pyrrol-2-ylboronic acid (CAS: 763120-43-0) is growing due to its applications in organic synthesis, particularly in palladium-catalyzed cross-coupling reactions. Research trends are focusing on its use in drug discovery and development, as well as in the synthesis of functional materials. The compound is also being explored for its potential in green chemistry processes and sustainable chemical manufacturing.

How should waste containing 1H-Pyrrol-2-ylboronic acid (CAS: 763120-43-0) be handled?

Waste containing 1H-Pyrrol-2-ylboronic acid (CAS: 763120-43-0) should be managed according to local and international hazardous waste regulations. Collection should be done in sealed, leak-proof containers. Incineration is one of the common disposal methods, but it should be performed in a controlled environment to minimize emissions. Professional waste disposal services are recommended to ensure compliance with environmental protection standards. Precautions include proper personal protective equipment and monitoring of air quality during handling and disposal processes.