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102365-46-8

102365-46-8 | [1,2,4]Triazolo[1,5-a][1,3,5]triazine-5,7-diamine

CAS No: 102365-46-8 Catalog No: AG00079P MDL No:MFCD18804222

Product Description

Catalog Number:
AG00079P
Chemical Name:
[1,2,4]Triazolo[1,5-a][1,3,5]triazine-5,7-diamine
CAS Number:
102365-46-8
Molecular Formula:
C4H5N7
Molecular Weight:
151.1294
MDL Number:
MFCD18804222
IUPAC Name:
[1,2,4]triazolo[1,5-a][1,3,5]triazine-5,7-diamine
InChI:
InChI=1S/C4H5N7/c5-2-9-3(6)11-4(10-2)7-1-8-11/h1H,(H4,5,6,7,8,9,10)
InChI Key:
NOKHJGLQLAKSKM-UHFFFAOYSA-N
SMILES:
Nc1nc(N)n2c(n1)ncn2

Properties

Complexity:
149  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.061g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
151.133g/mol
Monoisotopic Mass:
151.061g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
108A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8  

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