Home Nitriles 2,5-diaminopyridine-3-carbonitrile

2,5-diaminopyridine-3-carbonitrile

CAS No.:
1184645-19-9
Catalog Number:
AG01A2SG
Molecular Formula:
C6H6N4
Molecular Weight:
134.1386
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Product Description
Catalog Number:
AG01A2SG
Chemical Name:
2,5-diaminopyridine-3-carbonitrile
CAS Number:
1184645-19-9
Molecular Formula:
C6H6N4
Molecular Weight:
134.1386
MDL Number:
MFCD12768824
IUPAC Name:
2,5-diaminopyridine-3-carbonitrile
InChI:
InChI=1S/C6H6N4/c7-2-4-1-5(8)3-10-6(4)9/h1,3H,8H2,(H2,9,10)
InChI Key:
GKMXOWBTHCYDGI-UHFFFAOYSA-N
SMILES:
N#Cc1cc(N)cnc1N
Properties
Complexity:
158  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
134.059g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
134.142g/mol
Monoisotopic Mass:
134.059g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
88.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Properties