5-Chloro-1-methyl-4-nitro-1H-imidazole

Basic Information

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CAS Number

4897-25-0

Molecular Formula

C4H4ClN3O2

Molecular Weight

161.55 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

Agricultural Chemicals Pesticides Herbicides

Water Treatment Chemicals Coagulants and Flocculants Inorganic Coagulants

Basic Physical Properties

Melting Point

145.0 to 150.0 deg-C

Boiling Point

362.3℃ at 760 mmHg

Flash Point

172.9±22.3 °C

Refractive Index

1.5500 (estimate)

Vapor Pressure

0.0±0.8 mmHg at 25°C

SMILES

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CN1C=NC(=C1Cl)[N+](=O)[O-]

InChI

InChI=1S/C4H4ClN3O2/c1-7-2-6-4(3(7)5)8(9)10/h2H,1H3

InChIKey

OSJUNMSWBBOTQU-UHFFFAOYSA-N

LogP

1.50490

Complexity

148

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

SCHEMBL3236045
NSC-7852
Azathioprine Imp. C (EP); 5-Chloro-1-methyl-4-nitroimidazole; Azathioprine Impurity C
5-Chloro-1-methyl-4-nitro imidazole
FT-0620216
CS-0144974
SY020982
4897-25-0
BRN 0136775
AM20100205
MFCD00233664
5-Chloro-1-methyl-4-nitro-1H-imidazole #
Q27286392
5-CHLORO-1-METHYL-4-NITROIMIDAZOLE
5-Chloro-1-methyl-4-nitroimidazole, 98%
A(S50154-9)
CHEMBL1610328
HMS2797B15
NSC 7852
AC-11011
PD014739
Imidazole, 5-chloro-1-methyl-4-nitro-
W-106034
NCGC00246386-01
A7358
5-Chloro-1-methyl-4-nitro-1H-imidazole
PCMNI
1-Methyl-5-chloro-4-nitroimidazole
AKOS001116763
UNII-P917JW98BD
SMR000427350

MDL Number

MFCD00233664

Customs Code

2933290090

FAQ

What is 5-Chloro-1-methyl-4-nitro-1H-imidazole (CAS: 4897-25-0)?

5-Chloro-1-methyl-4-nitro-1H-imidazole is a chemical compound with the CAS number 4897-25-0. It has the chemical formula C6H5ClN2O and is a yellow crystalline solid with a characteristic odor. It belongs to the class of imidazole derivatives and is used in various applications including pharmaceuticals and research.

What are the main uses of 5-Chloro-1-methyl-4-nitro-1H-imidazole (CAS: 4897-25-0)?

5-Chloro-1-methyl-4-nitro-1H-imidazole is used in the pharmaceutical industry for the synthesis of certain drugs. It is also utilized in research for studying imidazole derivatives and their properties. Additionally, it is employed in the development of selective herbicides and as a starting material for other chemical compounds.

Is 5-Chloro-1-methyl-4-nitro-1H-imidazole (CAS: 4897-25-0) safe?

5-Chloro-1-methyl-4-nitro-1H-imidazole can be toxic if ingested or inhaled. It is important to handle the compound with appropriate personal protective equipment, such as gloves and safety goggles, and to work in a well-ventilated area. Storage should be in a secure location, away from flammable substances, and it should be handled according to safety data sheets (SDS) guidelines.

How should 5-Chloro-1-methyl-4-nitro-1H-imidazole (CAS: 4897-25-0) be stored?

5-Chloro-1-methyl-4-nitro-1H-imidazole should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed container to prevent the loss of volatile components. The storage temperature should be maintained between 15-25°C (59-77°F). It is important to avoid contact with incompatible materials such as acids and bases.