Home Nitriles 2-Pyrazinecarbonitrile, 6-fluoro-3,4-dihydro-3-oxo-

2-Pyrazinecarbonitrile, 6-fluoro-3,4-dihydro-3-oxo-

CAS No.:
356783-31-8
Catalog Number:
AG00C6D9
Molecular Formula:
C5H2FN3O
Molecular Weight:
139.0873
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Product Description
Catalog Number:
AG00C6D9
Chemical Name:
2-Pyrazinecarbonitrile, 6-fluoro-3,4-dihydro-3-oxo-
CAS Number:
356783-31-8
Molecular Formula:
C5H2FN3O
Molecular Weight:
139.0873
MDL Number:
MFCD19226655
IUPAC Name:
5-fluoro-2-oxo-1H-pyrazine-3-carbonitrile
InChI:
InChI=1S/C5H2FN3O/c6-4-2-8-5(10)3(1-7)9-4/h2H,(H,8,10)
InChI Key:
LJZHACRGZWYTAX-UHFFFAOYSA-N
SMILES:
N#Cc1nc(F)cnc1O
Properties
Complexity:
283  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
139.018g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
139.089g/mol
Monoisotopic Mass:
139.018g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
65.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3  
Properties