Home Other Building Blocks 7H-[1,2,4]triazolo[4,3-b][1,2,4]triazol-3-amine

7H-[1,2,4]triazolo[4,3-b][1,2,4]triazol-3-amine

CAS No.:
13728-21-7
Catalog Number:
AG01BBOL
Molecular Formula:
C3H4N6
Molecular Weight:
124.1041
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Product Description
Catalog Number:
AG01BBOL
Chemical Name:
7H-[1,2,4]triazolo[4,3-b][1,2,4]triazol-3-amine
CAS Number:
13728-21-7
Molecular Formula:
C3H4N6
Molecular Weight:
124.1041
MDL Number:
MFCD01893105
IUPAC Name:
5H-[1,2,4]triazolo[4,3-b][1,2,4]triazol-3-amine
InChI:
InChI=1S/C3H4N6/c4-2-7-8-3-5-1-6-9(2)3/h1H,(H2,4,7)(H,5,6,8)
InChI Key:
SSQHIBMRAFXEGP-UHFFFAOYSA-N
SMILES:
Nc1nnc2n1nc[nH]2
Properties
Complexity:
115  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
124.05g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
124.107g/mol
Monoisotopic Mass:
124.05g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
84.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5  
Properties