Home Nitriles 3-(ethylsulfanyl)pyrazine-2-carbonitrile

3-(ethylsulfanyl)pyrazine-2-carbonitrile

CAS No.:
74002-46-3
Catalog Number:
AG01BGSU
Molecular Formula:
C7H7N3S
Molecular Weight:
165.2156
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Product Description
Catalog Number:
AG01BGSU
Chemical Name:
3-(ethylsulfanyl)pyrazine-2-carbonitrile
CAS Number:
74002-46-3
Molecular Formula:
C7H7N3S
Molecular Weight:
165.2156
MDL Number:
MFCD16843442
IUPAC Name:
3-ethylsulfanylpyrazine-2-carbonitrile
InChI:
InChI=1S/C7H7N3S/c1-2-11-7-6(5-8)9-3-4-10-7/h3-4H,2H2,1H3
InChI Key:
KEVPXBMDWIPVQH-UHFFFAOYSA-N
SMILES:
CCSc1nccnc1C#N
Properties
Complexity:
162  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.036g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
165.214g/mol
Monoisotopic Mass:
165.036g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
74.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties