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Home > Nitro Compounds > 10199-90-3
10199-90-3 | 2,1,3-Benzoxadiazole, 4-azido-7-nitro-
CAS No: 10199-90-3 Catalog No: AG00066O MDL No:
Product Description
Catalog Number:
AG00066O
Chemical Name:
2,1,3-Benzoxadiazole, 4-azido-7-nitro-
CAS Number:
10199-90-3
Molecular Formula:
C6H2N6O3
Molecular Weight:
206.1185
IUPAC Name:
7-azido-4-nitro-2,1,3-benzoxadiazole
InChI:
InChI=1S/C6H2N6O3/c7-11-8-3-1-2-4(12(13)14)6-5(3)9-15-10-6/h1-2H
InChI Key:
YPRIQOMTFNRORM-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(c2c1non2)N=[N+]=[N-]
Properties
Complexity:
311
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.019g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.121g/mol
Monoisotopic Mass:
206.019g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
99.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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