Home Nitriles 5-(2,2,2-trifluoroethoxy)pyrazine-2-carbonitrile

5-(2,2,2-trifluoroethoxy)pyrazine-2-carbonitrile

CAS No.:
1339317-81-5
Catalog Number:
AG01BD55
Molecular Formula:
C7H4F3N3O
Molecular Weight:
203.1214
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Product Description
Catalog Number:
AG01BD55
Chemical Name:
5-(2,2,2-trifluoroethoxy)pyrazine-2-carbonitrile
CAS Number:
1339317-81-5
Molecular Formula:
C7H4F3N3O
Molecular Weight:
203.1214
MDL Number:
MFCD20284000
IUPAC Name:
5-(2,2,2-trifluoroethoxy)pyrazine-2-carbonitrile
InChI:
InChI=1S/C7H4F3N3O/c8-7(9,10)4-14-6-3-12-5(1-11)2-13-6/h2-3H,4H2
InChI Key:
FNZOJVMRDCHPQZ-UHFFFAOYSA-N
SMILES:
N#Cc1ncc(nc1)OCC(F)(F)F
Properties
Complexity:
234  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.031g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
203.124g/mol
Monoisotopic Mass:
203.031g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
58.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties