2,3-Pyrazinedicarbonitrile - CAS 13481-25-9
Catalog: |
BB008017 |
Product Name: |
2,3-Pyrazinedicarbonitrile |
CAS: |
13481-25-9 |
Synonyms: |
pyrazine-2,3-dicarbonitrile |
IUPAC Name: | pyrazine-2,3-dicarbonitrile |
Description: | 2,3-Pyrazinedicarbonitrile (CAS# 13481-25-9) is a useful research chemical. |
Molecular Weight: | 130.11 |
Molecular Formula: | C6H2N4 |
Canonical SMILES: | C1=CN=C(C(=N1)C#N)C#N |
InChI: | InChI=1S/C6H2N4/c7-3-5-6(4-8)10-2-1-9-5/h1-2H |
InChI Key: | OTVZGAXESBAAQQ-UHFFFAOYSA-N |
Boiling Point: | 362.2 °C at 760 mmHg |
Purity: | > 99.0 % (GC) |
Density: | 1.35 g/cm3 |
Appearance: | White to brown solid |
Storage: | Inert atmosphere, Room Temperature |
MDL: | MFCD00059771 |
LogP: | 0.21996 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Warning |
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PMID | Publication Date | Title | Journal |
22832539 | 20120921 | The effect of the number of carbohydrate moieties on the azaphthalocyanine properties | Dalton transactions (Cambridge, England : 2003) |
21206069 | 20110101 | The coordination polymer poly[(μ3-3-aminocarbonylpyrazine-2-carboxylato-κ3N1:O2:O2')silver(I)] | Acta crystallographica. Section C, Crystal structure communications |
21577624 | 20090822 | 5,6-Diphenyl-pyrazine-2,3-dicarbonitrile | Acta crystallographica. Section E, Structure reports online |
19583212 | 20090803 | 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 |
18446911 | 20080101 | Clathrate formation from octaazaphthalocyanines possessing bulky phenoxyl substituents: a new cubic crystal containing solvent-filled, nanoscale voids | Chemistry (Weinheim an der Bergstrasse, Germany) |
Complexity: | 180 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 130.027946081 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 130.027946081 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 73.4 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.4 |
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