3-Chloro-2,5-diethylpyrazine

Basic Information

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CAS Number

67714-53-8

Molecular Formula

C8H11ClN2

Molecular Weight

170.64 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

SMILES

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CCC1=CN=C(C(=N1)Cl)CC

InChI

InChI=1S/C8H11ClN2/c1-3-6-5-10-7(4-2)8(9)11-6/h5H,3-4H2,1-2H3

InChIKey

OHKRYVAKYCCYNX-UHFFFAOYSA-N

LogP

2.2548000000000004

Topological Polar Surface Area

25.78 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

119

Synonyms & References

English

AKOS005258264
3-chloro-2,5-diethylpyrazine
2-METHYL-1,4-NAPHTHOQUINONESODIUMBISULFATE
FT-0761611
NSC40821
OHKRYVAKYCCYNX-UHFFFAOYSA-N
CS-0054940
C16219
2-chloro-3,6-diethyl Pyrazine
DTXSID60285179
3-chloro-2,5-diethyl-pyrazine
3-CHLORO-2,5-DIETHYL PYRAZINE
67714-53-8
NSC-40821
SCHEMBL3839050
2-chloro-3,6-diethylpyrazine
3-Chloro-2,5-diethylpyrazine
Pyrazine,3-chloro-2,5-diethyl-
2-Chlor-3,6-diaethylpyrazin
2-Chloro-3,6-diethylpyrazine
3,6-diethyl-2-chloropyrazine
AC1L5YPE
AG-G-56472
ANW-54426
CTK5C6560

MDL Number

MFCD09265273

FAQ

What are the physical and chemical properties of 3-Chloro-2,5-diethylpyrazine (CAS: 67714-53-8)?

3-Chloro-2,5-diethylpyrazine is a crystalline solid at room temperature with a molecular weight of 185.61 g/mol. It has a low solubility in water but is more soluble in organic solvents. Chemically, it is relatively stable but can react with strong bases to form pyrazine derivatives. It has a characteristic odor and is used in flavoring applications.

How is 3-Chloro-2,5-diethylpyrazine (CAS: 67714-53-8) typically synthesized?

3-Chloro-2,5-diethylpyrazine is typically synthesized through the reaction of 2,5-diethylpyrazine with chlorine gas under appropriate conditions. The reaction is carried out in the presence of a catalyst like sodium hypochlorite to achieve high yield and selectivity. The process requires careful control of temperature and reaction time to prevent side reactions.

What industries use 3-Chloro-2,5-diethylpyrazine (CAS: 67714-53-8)?

3-Chloro-2,5-diethylpyrazine is primarily used in the food and flavor industry as a flavoring agent. It is also used in the fragrance industry to provide specific aroma notes. Additionally, it has applications in the pharmaceutical industry for certain types of flavoring and in the sensory evaluation of complex flavors.

What precautions should be taken when handling 3-Chloro-2,5-diethylpyrazine (CAS: 67714-53-8)?

When handling 3-Chloro-2,5-diethylpyrazine, it is important to wear proper personal protective equipment (PPE) such as gloves, goggles, and a lab coat. It should be stored in a well-ventilated area and handled in a fume hood to minimize exposure. In case of spill, it should be cleaned up using appropriate spill management procedures, and the incident should be reported to the safety officer. Always refer to the Material Safety Data Sheet (MSDS) for detailed safety information.