5-Methylpyrazine-2-carbonitrile

Basic Information

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CAS Number

98006-91-8

Molecular Formula

C6H5N3

Molecular Weight

119.12 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Nitriles

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Boiling Point

247 ºC

Density

1.16

Flash Point

96 ºC

SMILES

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CC1=CN=C(C=N1)C#N

InChI

InChI=1S/C6H5N3/c1-5-3-9-6(2-7)4-8-5/h3-4H,1H3

InChIKey

AYMRPLHDHGMXOF-UHFFFAOYSA-N

LogP

0.65668

Complexity

135

Synonyms & References

English

5-Methylpyrazine-2-carbonitrile
5-Methyl-2-pyrazinecarbonitrile
5-Methyl-pyrazin-2-carbonitrile
Pyrazinecarbonitrile, 5-methyl- (9CI)
2-Pyrazinecarbonitrile, 5-methyl-
2-Pyrazinecarbonitrile,5-methyl
2-Cyano-5-methylpyrazine
2-Methylpyrazine-5-carbonitrile
5-Methyl-2-cyanopyrazine
5-Methyl-2-pyrazinecarbonitrile (ACI)
EN300-106522
PYRAZINECARBONITRILE, 5-METHYL-
DTXSID80374998
Z1198164470
A1-24369
AYMRPLHDHGMXOF-UHFFFAOYSA-N
AS-42128
AB20698
5-methyl-pyrazin-2-carbonitrile
AKOS006294411
2-cyano-5-methylpyrazine
2-Methyl-5-Cyanopyrazine
SY022841
98006-91-8
5-methylpyrazine-2-carbonitrile
SCHEMBL2143383
J-517821
MFCD04116510
AC-30163
CS-0012682
5-Methyl-pyrazine-2-carbonitrile

MDL Number

MFCD04116510

Customs Code

2933990090

FAQ

What are the physical and chemical properties of 5-Methylpyrazine-2-carbonitrile (CAS: 98006-91-8)?

5-Methylpyrazine-2-carbonitrile (CAS: 98006-91-8) is a crystalline solid with a molecular weight of approximately 134.13 g/mol. It is slightly soluble in water but soluble in organic solvents like ethanol and acetone. The compound is known for its high reactivity towards nucleophiles, particularly in nucleophilic substitution reactions.

How is 5-Methylpyrazine-2-carbonitrile (CAS: 98006-91-8) typically synthesized?

5-Methylpyrazine-2-carbonitrile (CAS: 98006-91-8) is typically synthesized by the reaction of methyl cyanoacetate with hydrated zinc acetate under mild conditions. This process involves a nucleophilic substitution, leading to high yield and good selectivity.

What industries use 5-Methylpyrazine-2-carbonitrile (CAS: 98006-91-8)?

5-Methylpyrazine-2-carbonitrile (CAS: 98006-91-8) finds application in the pharmaceutical industry as an intermediate in the synthesis of certain drugs. It is also used in the polymer industry for modifying polymer properties and in the sensor industry for its unique chemical sensing capabilities.

What precautions should be taken when handling 5-Methylpyrazine-2-carbonitrile (CAS: 98006-91-8)?

When handling 5-Methylpyrazine-2-carbonitrile (CAS: 98006-91-8), it is essential to use appropriate personal protective equipment (PPE) such as gloves and safety goggles. Store the compound in a cool, dry place, away from strong oxidizers and acids. In the event of a spill, immediately clean it up using absorbent material and follow the safety data sheet (SDS) guidelines for disposal.