2-Iodooxazole | CAS No. 877614-97-6

2-Iodooxazole

Basic Information

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CAS Number

877614-97-6

Molecular Formula

C3H2INO

Molecular Weight

194.96 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Agricultural Chemicals Pesticides Herbicides

Water Treatment Chemicals Disinfectants Chlorine Compounds

Basic Physical Properties

Boiling Point

198.1±23.0℃ at 760 mmHg

SMILES

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C1=COC(=N1)I

InChI

InChI=1S/C3H2INO/c4-3-5-1-2-6-3/h1-2H

InChIKey

QIXCSHIEHGEJGB-UHFFFAOYSA-N

LogP

1.2792000000000001

Topological Polar Surface Area

26.03 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

50.1

Synonyms & References

English

2-Iodooxazole
2-Iodo-1,3-oxazole
Oxazole, 2-iodo-
QIXCSHIEHGEJGB-UHFFFAOYSA-N
PB15201
2-iodo-1,3-oxazole
2-Iodooxazole (ACI)
877614-97-6
CKB61497
AKOS023095420
SY098116
DB-003279
SCHEMBL2224824
EN300-1234964
2-IODO-1,3-OXAZOLE
AS-34298
MFCD15527546
CS-0051894
F2196-0053
2-IODOOXAZOLE
CHEMBL4591940

MDL Number

MFCD15527546

FAQ

What regulatory guidelines apply to 2-Iodooxazole (CAS: 877614-97-6)?

2-Iodooxazole (CAS: 877614-97-6) is regulated under the Globally Harmonized System of Classification and Labelling of Chemicals (GHS) as a flammable liquid. It is also subject to the European Union’s Registration, Evaluation, Authorisation, and Restriction of Chemicals (REACH) regulation, which requires manufacturers and importers to register substances with the European Chemicals Agency (ECHA). In the United States, the Environmental Protection Agency (EPA) and the Food and Drug Administration (FDA) may have additional specific requirements for handling and reporting of this compound.

Are there alternatives to 2-Iodooxazole (CAS: 877614-97-6) in synthesis?

There are several alternatives to 2-Iodooxazole in synthesis, including 2-Chlorooxazole and 2-Bromo-1-oxazole. These compounds may be used as isomers or analogs depending on the specific reaction conditions and desired product. Common alternative reagents include various halogenated heterocycles that can be substituted based on the reaction requirements.

What is the market or research trend for 2-Iodooxazole (CAS: 877614-97-6)?

The market trend for 2-Iodooxazole (CAS: 877614-97-6) reflects increasing demand in pharmaceuticals and analytical chemistry. Research is focusing on its potential applications in drug discovery and as precursors for other heterocyclic compounds. The trend indicates growing interest in its synthesis and utility across various industries, particularly in the development of novel pharmaceuticals and advanced materials.

How should waste containing 2-Iodooxazole (CAS: 877614-97-6) be handled?

Waste containing 2-Iodooxazole (CAS: 877614-97-6) should be collected and stored in appropriate containers to prevent spills and contamination. The waste should be treated by incineration or other professional waste disposal methods to ensure compliance with local and international environmental regulations. Proper precautions should be taken to prevent the release of iodine vapor, which can be harmful, and to handle the waste in a manner that minimizes environmental impact.