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55557-52-3 | 2-Chloro-3-cyanopyrazine
CAS No: 55557-52-3 Catalog No: AG0033OM MDL No:MFCD00219653
Product Description
Catalog Number:
AG0033OM
Chemical Name:
2-Chloro-3-cyanopyrazine
CAS Number:
55557-52-3
Molecular Formula:
C5H2ClN3
Molecular Weight:
139.5425
MDL Number:
MFCD00219653
IUPAC Name:
3-chloropyrazine-2-carbonitrile
InChI:
InChI=1S/C5H2ClN3/c6-5-4(3-7)8-1-2-9-5/h1-2H
InChI Key:
SDLFAEGTVBPHBK-UHFFFAOYSA-N
SMILES:
N#Cc1nccnc1Cl
NSC Number:
158245
Properties
Complexity:
138
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
138.994g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
139.542g/mol
Monoisotopic Mass:
138.994g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
49.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
Literature
| Title | Journal |
|---|---|
| Synthesis and antibacterial activity of 1H-pyrazolo[3,4-b]pyrazine and -pyridine derivatives. | Farmaco (Societa chimica italiana : 1989) 20050101 |
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