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117039-77-7

117039-77-7 | 4H-Imidazo[1,2-d]tetrazole, 5,6-dihydro-4-nitro-

CAS No: 117039-77-7 Catalog No: AG000DM0 MDL No:

Product Description

Catalog Number:
AG000DM0
Chemical Name:
4H-Imidazo[1,2-d]tetrazole, 5,6-dihydro-4-nitro-
CAS Number:
117039-77-7
Molecular Formula:
C3H4N6O2
Molecular Weight:
156.1029
IUPAC Name:
4-nitro-5,6-dihydroimidazo[2,1-e]tetrazole
InChI:
InChI=1S/C3H4N6O2/c10-9(11)8-2-1-7-3(8)4-5-6-7/h1-2H2
InChI Key:
FRPKRTDWHLMWOU-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)N1CCn2c1nnn2

Properties

Complexity:
179  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.04g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
156.105g/mol
Monoisotopic Mass:
156.04g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
92.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  

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