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CAS Number: 39095-25-5
2,5-dimethylterephthalonitrile

Structure

2,5-dimethylterephthalonitrile
Name: 2,5-dimethylterephthalonitrile
Synonyms:
General Information
Product Number: 39095255
CAS Registry Number:
39095-25-5
Name:
1,4-Benzenedicarbonitrile, 2,5-dimethyl-
Terephthalonitrile, 2,5-dimethyl- (6CI); 1,4-Dicyano-2,5-dimethylbenzene; 2,5-Dicyano-p-xylene; 2,5-Dimethylterephthalonitrile 
 
Chemical Formula: C10H8N2
Exact Mass: 156.07
Molecular Weight: 156.18
m/z: 156.07 (100.0%), 157.07 (11.6%)
Elemental Analysis: C, 76.90; H, 5.16; N, 17.94
 
InChI: InChI=1S/C10H8N2/c1-7-3-10(6-12)8(2)4-9(7)5-11/h3-4H,1-2H3
InChIKey: ZSJIRGBDYMYVDO-UHFFFAOYSA-N
Canonical SMILES : CC1=CC(=C(C=C1C#N)C)C#N
 
Thermal Properties Value Condition Note
Melting Point 210 °C (sublm) Solv: ethanol (64-17-5) (3)CAS
Melting Point 209.5-210 °C   (4)CAS

Specification

98%

References

  • (3) Cachia, Marc; Bulletin de la Societe Chimique de France 1958, P1418-25 CAPLUS
  • (4) de Dirs-Bach, Henri; Helvetica Chimica Acta 1923, V6, P539-48 CAPLUS
  • (5) Ugi, Ivar; FR 1384210 1965 CAPLUS
  • (6) Huang, Chibao; CN 102154005 A 2011 CAPLUS
  • (7) Suvorov, B. V.; Neftekhimiya 1979, V19(2), P230-6 CAPLUS
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