4-Acetylimidazole

Basic Information

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CAS Number

61985-25-9

Molecular Formula

C5H6N2O

Molecular Weight

110.12 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Water Treatment Chemicals Coagulants and Flocculants Inorganic Coagulants

Basic Physical Properties

Physical State

White to Yellow Solid

Melting Point

169-170 ºC

Boiling Point

329.4°C at 760 mmHg

Density

1.190

Flash Point

157.382 °C

SMILES

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CC(=O)C1=CN=CN1

InChI

InChI=1S/C5H6N2O/c1-4(8)5-2-6-3-7-5/h2-3H,1H3,(H,6,7)

InChIKey

TUFOJIVMBHBZRQ-UHFFFAOYSA-N

LogP

0.6123000000000001

Topological Polar Surface Area

45.75 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

103

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

4-Acetylimidazole
1-(1H-Imidazol-4-yl)ethanone
1-(1H-IMIDAZOL-4-YL)-ETHANONE
1-(1H-IMIDAZOL-4-YL)-ETHANONE HCL
1-(1H-imidazol-5-yl)ethanone
4-Acetyl-1H-imidazole
4-ethoxy-1H-imidazole
1-(1(3)H-imidazol-4-yl)-ethanone
4(5)-acetyl-1H-imidazole
4-Acetylimidazol
5-Acetylimidazol
5-acetylimidazole
4-Methylcarbonylimidazole
1-(1H-imidazol-4-yl)ethan-1-one
TUFOJIVMBHBZRQ-UHFFFAOYSA-N
Ethanone, 1-(1H-imidazol-5-yl)-
Ethanone, 1-(1H-imidazol-4-yl)-
1-(3H-Imidazol-4-yl)-ethanone
ethanone,1-(1h-imidazol-5-yl)-
1-(1H-Imidazol-5-yl)ethanone #
ANW
1-(1H-imidazol-4-yl)ethanone
SY042637
1-(1h-imidazol-4-yl)ethanone
61985-25-9
Z1198183596
DB-012315
MFCD18829020
1-(1H-Imidazol-5-yl)ethanone
SCHEMBL631784
AC-006

MDL Number

MFCD09033077

Customs Code

2933290090

FAQ

What regulatory guidelines apply to 4-Acetylimidazole (CAS: 61985-25-9)?

4-Acetylimidazole (CAS: 61985-25-9) is regulated under the Globally Harmonized System of Classification and Labeling of Chemicals (GHS), REACH in the EU, and by the FDA and EPA in the US. It is classified as a hazardous substance that requires proper labeling and handling to prevent exposure and ensure workplace safety. Detailed safety data sheets (SDS) are required for storage, transportation, and disposal of the compound.

Are there alternatives to 4-Acetylimidazole (CAS: 61985-25-9) in synthesis?

Yes, there are alternatives to 4-Acetylimidazole (CAS: 61985-25-9) in synthesis, such as 4-imidazole and 4-aminopyridine, which can be used as precursors for similar chemical reactions. These alternatives offer similar functional groups but may have different reactivity profiles, providing options depending on the specific synthesis requirements and desired properties of the final product.

What is the market or research trend for 4-Acetylimidazole (CAS: 61985-25-9)?

The market for 4-Acetylimidazole (CAS: 61985-25-9) is driven by its applications in pharmaceuticals and biotechnology. Research trends highlight its use as an intermediate in drug synthesis, particularly in antiviral and antifungal drug development. Market trends show increasing demand due to ongoing pharmaceutical research and development, with a focus on its potential in novel therapeutic applications.

How should waste containing 4-Acetylimidazole (CAS: 61985-25-9) be handled?

Waste containing 4-Acetylimidazole (CAS: 61985-25-9) should be collected in appropriate containers that are compatible with the chemical and labeled accordingly. Incineration is a common method for disposal, but professional waste disposal services should be used to ensure compliance with environmental regulations. It is crucial to adhere to local and national waste management laws to prevent environmental contamination and ensure safe disposal.