Structure

5-methylpyrazine-2-carbonitrile

CAS
98006-91-8
Catalog Number
ACM98006918
Category
Pyrazines
Molecular Weight
119.1
Molecular Formula
C6H5N3

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Specification

Appearance
Yellow liquid
What is the molecular formula of 5-methylpyrazine-2-carbonitrile?

The molecular formula of 5-methylpyrazine-2-carbonitrile is C6H5N3.

What is the molecular weight of 5-methylpyrazine-2-carbonitrile?

The molecular weight of 5-methylpyrazine-2-carbonitrile is 119.12 g/mol.

What are some synonyms for 5-methylpyrazine-2-carbonitrile?

Some synonyms for 5-methylpyrazine-2-carbonitrile include 98006-91-8, 2-cyano-5-methylpyrazine, and PYRAZINECARBONITRILE, 5-METHYL.

What is the IUPAC Name of 5-methylpyrazine-2-carbonitrile?

The IUPAC Name of 5-methylpyrazine-2-carbonitrile is 5-methylpyrazine-2-carbonitrile.

What is the InChIKey of 5-methylpyrazine-2-carbonitrile?

The InChIKey of 5-methylpyrazine-2-carbonitrile is AYMRPLHDHGMXOF-UHFFFAOYSA-N.

What is the Canonical SMILES representation of 5-methylpyrazine-2-carbonitrile?

The Canonical SMILES representation of 5-methylpyrazine-2-carbonitrile is CC1=CN=C(C=N1)C#N.

How many hydrogen bond acceptors does 5-methylpyrazine-2-carbonitrile have?

5-methylpyrazine-2-carbonitrile has 3 hydrogen bond acceptors.

What is the topological polar surface area of 5-methylpyrazine-2-carbonitrile?

The topological polar surface area of 5-methylpyrazine-2-carbonitrile is 49.6 Å2.

Does 5-methylpyrazine-2-carbonitrile have any defined atom stereocenters?

5-methylpyrazine-2-carbonitrile does not have any defined atom stereocenters.

Is the compound 5-methylpyrazine-2-carbonitrile canonicalized?

Yes, the compound 5-methylpyrazine-2-carbonitrile is canonicalized.

Upstream Synthesis Route 1

  • 25594-37-0
  • 7677-24-9
  • 65735-15-1
  • 98006-91-8

Reference: [1]Journal of the Chemical Society. Perkin transactions I,1991,p. 2877 - 2882

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