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CAS Number: 1000564-45-3
2-(pyrimidin-5-yl)acetonitrile

Structure

2-(pyrimidin-5-yl)acetonitrile
Name: 2-(pyrimidin-5-yl)acetonitrile
Synonyms:
General Information
Product Number: 1000564453
CAS Registry Number: 1000564-45-3
Name:
        5-​Pyrimidineacetonitri​le
        2-​(Pyrimidin-​5-​yl)​acetonitrile 
 
Chemical Formula: C6H5N3
Exact Mass: 119.05
Molecular Weight: 119.12
m/z: 119.05 (100.0%), 120.05 (7.7%)
Elemental Analysis: C, 60.50; H, 4.23; N, 35.27
 
InChI: InChI=1S/C6H5N3/c7-2-1-6-3-8-5-9-4-6/h3-5H,1H2
InChIKey: WBXNRDHUHUWTDU-UHFFFAOYSA-N
Canonical SMILES : C1=C(C=NC=N1)CC#N

Specification

98%

References

PCT Int. Appl. (2014), WO 2014057078 A1 20140417. 

PCT Int. Appl. (2013), WO 2013150416 A1 20131010.

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