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123188-98-7 | 2,3-Pyrazinedicarbonitrile, 5-amino-6-(methylamino)-
CAS No: 123188-98-7 Catalog No: AG000K4L MDL No:
Product Description
Catalog Number:
AG000K4L
Chemical Name:
2,3-Pyrazinedicarbonitrile, 5-amino-6-(methylamino)-
CAS Number:
123188-98-7
Molecular Formula:
C7H6N6
Molecular Weight:
174.1627
IUPAC Name:
5-amino-6-(methylamino)pyrazine-2,3-dicarbonitrile
InChI:
InChI=1S/C7H6N6/c1-11-7-6(10)12-4(2-8)5(3-9)13-7/h1H3,(H2,10,12)(H,11,13)
InChI Key:
SCSZJMOZWBCRPM-UHFFFAOYSA-N
SMILES:
N#Cc1nc(NC)c(nc1C#N)N
Properties
Complexity:
269
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.065g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
174.167g/mol
Monoisotopic Mass:
174.065g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
111A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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