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89391-41-3 | Spiro[9H-fluorene-9,4'-imidazolidine]-2',5'-dione, 2-nitro-
CAS No: 89391-41-3 Catalog No: AG003WCS MDL No:
Product Description
Catalog Number:
AG003WCS
Chemical Name:
Spiro[9H-fluorene-9,4'-imidazolidine]-2',5'-dione, 2-nitro-
CAS Number:
89391-41-3
Molecular Formula:
C15H9N3O4
Molecular Weight:
295.2497
IUPAC Name:
2-nitrospiro[fluorene-9,5'-imidazolidine]-2',4'-dione
InChI:
InChI=1S/C15H9N3O4/c19-13-15(17-14(20)16-13)11-4-2-1-3-9(11)10-6-5-8(18(21)22)7-12(10)15/h1-7H,(H2,16,17,19,20)
InChI Key:
BOOSGHFMEZVFGR-UHFFFAOYSA-N
SMILES:
O=C1NC(=O)C2(N1)c1cc(ccc1c1c2cccc1)[N+](=O)[O-]
Properties
Complexity:
545
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.059g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
295.254g/mol
Monoisotopic Mass:
295.059g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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