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13481-25-9

13481-25-9 | Pyrazine-2,3-dicarbonitrile

CAS No: 13481-25-9 Catalog No: AG003U1T MDL No:MFCD00059771

Product Description

Catalog Number:
AG003U1T
Chemical Name:
Pyrazine-2,3-dicarbonitrile
CAS Number:
13481-25-9
Molecular Formula:
C6H2N4
Molecular Weight:
130.1069
MDL Number:
MFCD00059771
IUPAC Name:
pyrazine-2,3-dicarbonitrile
InChI:
InChI=1S/C6H2N4/c7-3-5-6(4-8)10-2-1-9-5/h1-2H
InChI Key:
OTVZGAXESBAAQQ-UHFFFAOYSA-N
SMILES:
N#Cc1nccnc1C#N
NSC Number:
175270

Properties

Complexity:
180  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
130.028g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
130.11g/mol
Monoisotopic Mass:
130.028g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
73.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  

Literature

Title Journal
The effect of the number of carbohydrate moieties on the azaphthalocyanine properties. Dalton transactions (Cambridge, England : 2003) 20120921
The coordination polymer poly[(μ3-3-aminocarbonylpyrazine-2-carboxylato-κ3N1:O2:O2')silver(I)]. Acta crystallographica. Section C, Crystal structure communications 20110101
5,6-Diphenyl-pyrazine-2,3-dicarbonitrile. Acta crystallographica. Section E, Structure reports online 20090901
Structural, UV-visible, and electrochemical studies on 2,3-dicyano-5,6-di-2-pyridylpyrazine, [(CN)2Py2Pyz], related species and its complexes [(CN)2Py2PyzMCl2] (M = Pt(II), Pd(II)). Inorganic chemistry 20090803
Clathrate formation from octaazaphthalocyanines possessing bulky phenoxyl substituents: a new cubic crystal containing solvent-filled, nanoscale voids. Chemistry (Weinheim an der Bergstrasse, Germany) 20080101
Biotransformation of heterocyclic dinitriles by Rhodococcus erythropolis and fungal nitrilases. Biotechnology letters 20070701

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