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80267-67-0 | 6-nitronaphthalene-1,4-dione
CAS No: 80267-67-0 Catalog No: AG00GJ83 MDL No:
Product Description
Catalog Number:
AG00GJ83
Chemical Name:
6-nitronaphthalene-1,4-dione
CAS Number:
80267-67-0
IUPAC Name:
6-nitronaphthalene-1,4-dione
InChI:
InChI=1S/C10H5NO4/c12-9-3-4-10(13)8-5-6(11(14)15)1-2-7(8)9/h1-5H
InChI Key:
XDIWXFTZTJQXDE-UHFFFAOYSA-N
Properties
Complexity:
355
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.022g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
203.153g/mol
Monoisotopic Mass:
203.022g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
80A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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