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Structure

2,3-Dicyano-5-methylpyrazine

CAS
52197-12-3
Catalog Number
ACM52197123
Category
Other Products
Molecular Weight
144.13
Molecular Formula
C7H4N4

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Specification

Synonyms
2,3-Dicyano-5-methylpyrazine, 5-methyl-2,3-pyrazinedicarbonitrile, MolPort-001-846-850, NSC175273, CID300516, ZINC00337842, D2281, AQ-917/42754173, 52197-12-3
IUPAC Name
5-methylpyrazine-2,3-dicarbonitrile
Canonical SMILES
CC1=CN=C(C(=N1)C#N)C#N
InChI Key
RHYUBLSWHDYKAO-UHFFFAOYSA-N
Boiling Point
377.3ºC at 760 mmHg
Melting Point
100ºC
Flash Point
128.3ºC
Density
1.28g/cm³
Exact Mass
144.04400
H-Bond Acceptor
4
H-Bond Donor
0
Safety Description
26-36/37/39

Upstream Synthesis Route 1

  • 1187-42-4
  • 78-98-8
  • 52197-12-3

Reference: [1] Journal of Heterocyclic Chemistry, 1997, vol. 34, # 3, p. 973 - 981

Upstream Synthesis Route 2

  • 1187-42-4
  • 78-98-8
  • 52197-12-3

Reference: [1]Journal of Heterocyclic Chemistry,1997,vol. 34,p. 973 - 981

Downstream Synthesis Route 1

  • 52197-12-3
  • 5521-60-8

Reference: [1]Bulletin des Societes Chimiques Belges,1983,vol. 92,p. 999 - 1010
[2]Agricultural and Biological Chemistry,1981,vol. 45,p. 2129 - 2130

Downstream Synthesis Route 2

  • 52197-12-3
  • 119298-80-5

Reference: [1]Liebigs Annalen der Chemie,1989,p. 497 - 500

* For details of the synthesis route, please refer to the original source to ensure accuracy.

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