2-Butyl-4-chloro-1H-imidazole-5-carbaldehyde

Basic Information

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CAS Number

83857-96-9

Molecular Formula

C8H11ClN2O

Molecular Weight

186.64 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Aldehydes

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

Basic Physical Properties

Melting Point

97-100 °C

Boiling Point

384.1±22.0 °C at 760 mmHg

Density

1.240

Flash Point

186.1±22.3 °C

Solubility

slightly soluble

SMILES

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CCCCC1=NC(=C(N1)Cl)C=O

InChI

InChI=1S/C8H11ClN2O/c1-2-3-4-7-10-6(5-12)8(9)11-7/h5H,2-4H2,1H3,(H,10,11)

InChIKey

JLVIHQCWASNXCK-UHFFFAOYSA-N

LogP

2.2182000000000004

Topological Polar Surface Area

45.75 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

154

Safety Information

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Hazard Statement

H317 May cause an allergic skin reaction
Sensitization, Skin

H411 Toxic to aquatic life with long lasting effects
Hazardous to the aquatic environment, long-term hazard

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

2-(But-1-yl)-5-chloro-1H-imidazole-4-carboxaldehyde
MLS006011660
2-Butyl-5-chloroimidazole-4-carbaldehyde
2-n-butyl-5-chlorimidazole-4-carbaldehyde
2-butyl-5-formyl-4-chloroimidazole
2-butyl-4-chloro-5-formyl imidazole
83857-96-9
7H170U0SWE
AM20110204
2-BUTYL-5-CHLORO-4-FORMYLIMIDAZOLE
A840670
4-CHLORO-2-N-BUTYLIMIDAZOLE-5-CARBOXALDEHYDE
UNII-7H170U0SWE
2-Butyl-5-chloro-1H-imidazole-4-carboxaldehyde, 97%
Q27268274
DTXSID4075039
Losartan Intermediates
SY018323
SR-01000944870
SR-01000944870-1
2-Butyl-5-chloro-1H-imidazole-4-carboxaldehyde
Losartan impurity D, European Pharmacopoeia (EP) Reference Standard
2-butyl-4-chloro-5-formylimidazole; 2-butyl-5-chloro-1h-imidazole-4-carbaldehyde; 2-butyl-4-chloro-1h-imidazole-5-carboxaldehyde
B2914
NS00007091
4-chloro-2-butyl-1H-imidazole-5-carbaldehyde
BP-10310
US9138393, 2-Butyl-4-chloro- 5-formylimidazole
2-n-butyl-4-chloro-1H-imidazole 5-carboxaldehyde
2-butyl-5-chloro-3H-imidazole-4-carbaldehyde
2-n-butyl 4-chloro 1H-imidazol 5-carboxaldehyde

MDL Number

MFCD01934396

Customs Code

2933290090

FAQ

What is 2-Butyl-4-chloro-1H-imidazole-5-carbaldehyde (CAS: 83857-96-9)?

2-Butyl-4-chloro-1H-imidazole-5-carbaldehyde (CAS: 83857-96-9) is an organic compound with the molecular formula C8H9ClN2O. It belongs to the imidazole class, featuring a carbaldehyde group at the 5-position and a butyl chain at the 2-position. The compound is typically a yellow solid with a moderately polar character and exhibits functional group reactivity common to imidazole derivatives.

What are the main uses of 2-Butyl-4-chloro-1H-imidazole-5-carbaldehyde (CAS: 83857-96-9)?

2-Butyl-4-chloro-1H-imidazole-5-carbaldehyde (CAS: 83857-96-9) is primarily used in pharmaceutical research as a building block for drug synthesis, particularly in the development of antifungal and antimicrobial agents. It also finds applications in organic chemistry for creating derivatives and intermediates, and in industrial settings for specialized chemical processes requiring imidazole-based compounds.

Is 2-Butyl-4-chloro-1H-imidazole-5-carbaldehyde (CAS: 83857-96-9) safe?

2-Butyl-4-chloro-1H-imidazole-5-carbaldehyde (CAS: 83857-96-9) requires careful handling due to its potential irritancy to skin, eyes, and respiratory systems. Safety data sheets (SDS) recommend using appropriate personal protective equipment (PPE) such as gloves and goggles. While not classified as highly toxic, it should be handled in well-ventilated areas and stored away from incompatible materials to ensure compliance with chemical safety standards.

How should 2-Butyl-4-chloro-1H-imidazole-5-carbaldehyde (CAS: 83857-96-9) be stored?

2-Butyl-4-chloro-1H-imidazole-5-carbaldehyde (CAS: 83857-96-9) should be stored in a sealed container in a cool, dry place, preferably at 2-8°C, to maintain stability. It is hygroscopic, so protection from moisture and light is essential. Avoid exposure to air and store in a well-ventilated area to prevent degradation and ensure safe chemical storage practices.