Home Nitriles 1H-Imidazole-4-carbonitrile,1,5-diamino-

1H-Imidazole-4-carbonitrile,1,5-diamino-

CAS No.:
141563-06-6
Catalog Number:
AG006XKQ
Molecular Formula:
C4H5N5
Molecular Weight:
123.1160
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Product Description
Catalog Number:
AG006XKQ
Chemical Name:
1H-Imidazole-4-carbonitrile,1,5-diamino-
CAS Number:
141563-06-6
Molecular Formula:
C4H5N5
Molecular Weight:
123.1160
MDL Number:
MFCD00215309
IUPAC Name:
1,5-diaminoimidazole-4-carbonitrile
InChI:
InChI=1S/C4H5N5/c5-1-3-4(6)9(7)2-8-3/h2H,6-7H2
InChI Key:
ICCPRBNZPFLELO-UHFFFAOYSA-N
SMILES:
N#Cc1ncn(c1N)N
Properties
Complexity:
146  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
123.054g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
123.119g/mol
Monoisotopic Mass:
123.054g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
93.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Properties