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1134-13-0 | 2-Pyrazinecarboxamide, 3,5-diamino-N-(aminoiminomethyl)-
CAS No: 1134-13-0 Catalog No: AG0008FE MDL No:
Product Description
Catalog Number:
AG0008FE
Chemical Name:
2-Pyrazinecarboxamide, 3,5-diamino-N-(aminoiminomethyl)-
CAS Number:
1134-13-0
Molecular Formula:
C6H9N7O
Molecular Weight:
195.1820
IUPAC Name:
3,5-diamino-N-methanehydrazonoylpyrazine-2-carboxamide
InChI:
InChI=1S/C6H9N7O/c7-3-1-10-4(5(8)13-3)6(14)11-2-12-9/h1-2H,9H2,(H4,7,8,13)(H,11,12,14)
InChI Key:
JKSXQQGGLYZARU-UHFFFAOYSA-N
SMILES:
NN=CNC(=O)c1ncc(nc1N)N
Properties
Complexity:
230
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.087g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
195.186g/mol
Monoisotopic Mass:
195.087g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
145A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
-1
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