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Home > Nitro Compounds > 72365-05-0
72365-05-0 | 1H-Naphtho[2,3-d]triazole-4,9-dione, 6-nitro-
CAS No: 72365-05-0 Catalog No: AG005U0B MDL No:
Product Description
Catalog Number:
AG005U0B
Chemical Name:
1H-Naphtho[2,3-d]triazole-4,9-dione, 6-nitro-
CAS Number:
72365-05-0
Molecular Formula:
C10H4N4O4
Molecular Weight:
244.1632
IUPAC Name:
6-nitro-2H-benzo[f]benzotriazole-4,9-dione
InChI:
InChI=1S/C10H4N4O4/c15-9-5-2-1-4(14(17)18)3-6(5)10(16)8-7(9)11-13-12-8/h1-3H,(H,11,12,13)
InChI Key:
BUOSABXNKKCWBW-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc2c(c1)C(=O)c1c(C2=O)[nH]nn1
Properties
Complexity:
421
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.023g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
244.166g/mol
Monoisotopic Mass:
244.023g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
122A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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