1,5-Dimethyl-4-nitroimidazole

Basic Information

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CAS Number

7464-68-8

Molecular Formula

C5H7N3O2

Molecular Weight

141.13 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

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

Melting Point

153-157 ºC

Density

1.36±0.1 g/cm3 (20 ºC 760 Torr),

SMILES

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CC1=C(N=CN1C)[N+](=O)[O-]

InChI

InChI=1S/C5H7N3O2/c1-4-5(8(9)10)6-3-7(4)2/h3H,1-2H3

InChIKey

ULEIQLOXYAULFE-UHFFFAOYSA-N

LogP

1.15990

Complexity

144

Synonyms & References

English

1H-Imidazole, 1,5-dimethyl-4-nitro-
AKOS025404413
5G7RGP46ZX
Imidazole, 1,5-dimethyl-4-nitro-
NSC-400014
UNII-5G7RGP46ZX
NSC400014
1,5-Dimethyl-4-nitro-1H-imidazole (9CI)
A865846
1,5-dimethyl-4-nitroimidazole
ULEIQLOXYAULFE-UHFFFAOYSA-N
AS-31706
SY023762
7464-68-8
1 pound not5-Dimethyl-4-nitroimidazole
Imidazole,5-dimethyl-4-nitro-
BRN 0127676
1,5-DIMETHYL-4-NITRO-1H-IMIDAZOLE
MFCD01721572
1H-Imidazole,5-dimethyl-4-nitro-
SCHEMBL422634
NSC 400014
FT-0714680
DTXSID40225619
1,5-dimethyl-4-nitro-1H-Imidazole
1,5-Dimethyl-4-nitro-1H-imidazol
1,5-Dimethyl-4-nitro-imidazol
1,5-dimethyl-4-nitro-imidazole
1,5-Dimethyl-4-nitroimidazole
1H-Imidazole,1,5-dimethyl-4-nitro
Imidazole,1,5-dimethyl-4-nitro

MDL Number

MFCD01721572

Customs Code

2933290090

FAQ

What are the physical and chemical properties of 1,5-Dimethyl-4-nitroimidazole (CAS: 7464-68-8)?

1,5-Dimethyl-4-nitroimidazole (CAS: 7464-68-8) is a crystalline solid with a molecular weight of 178.12 g/mol. It has a melting point of 122-124°C and is slightly soluble in water. This compound is moderately reactive, especially under acidic or basic conditions, and it decomposes when heated above 140°C. It is also susceptible to hydrolysis in aqueous solutions.

How is 1,5-Dimethyl-4-nitroimidazole (CAS: 7464-68-8) typically synthesized?

1,5-Dimethyl-4-nitroimidazole is typically synthesized through the nitration of 1,5-dimethylimidazole. The nitration process involves the use of concentrated nitric acid and sulfuric acid as the nitrating agent. The reaction is carried out at low temperature, and the product can be isolated by recrystallization. The yield is generally around 70-80%, and the process requires careful control of temperature and concentration to ensure selectivity.

What industries use 1,5-Dimethyl-4-nitroimidazole (CAS: 7464-68-8)?

1,5-Dimethyl-4-nitroimidazole finds applications in various industries. In the pharmaceutical sector, it serves as a precursor for the synthesis of drugs. It is also used in the production of sensors due to its ability to interact with specific gases. Additionally, it has applications in the polymer industry for the development of new materials and in the semiconductor industry for its potential as a dopant.

What precautions should be taken when handling 1,5-Dimethyl-4-nitroimidazole (CAS: 7464-68-8)?

When handling 1,5-Dimethyl-4-nitroimidazole (CAS: 7464-68-8), it is important to wear appropriate personal protective equipment (PPE), including gloves, goggles, and a lab coat. The compound should be used in a well-ventilated area or a fume hood due to its potential for release of toxic fumes. Spills should be handled carefully using absorbent materials and the area should be thoroughly cleaned. Always refer to the safety data sheet (SDS) for specific guidelines and emergency procedures.