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Home > Nitro Compounds > 15514-21-3
15514-21-3 | Benzene, 1,1'-selenobis[2,4-dinitro-
CAS No: 15514-21-3 Catalog No: AG001NNZ MDL No:
Product Description
Catalog Number:
AG001NNZ
Chemical Name:
Benzene, 1,1'-selenobis[2,4-dinitro-
CAS Number:
15514-21-3
Molecular Formula:
C12H6N4O8Se
Molecular Weight:
413.1580
IUPAC Name:
1-(2,4-dinitrophenyl)selanyl-2,4-dinitrobenzene
InChI:
InChI=1S/C12H6N4O8Se/c17-13(18)7-1-3-11(9(5-7)15(21)22)25-12-4-2-8(14(19)20)6-10(12)16(23)24/h1-6H
InChI Key:
JIRPZDAKAYDFBI-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(ccc1[Se]c1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]
Properties
Complexity:
505
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
413.935g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
413.171g/mol
Monoisotopic Mass:
413.935g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
183A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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