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Home > Imidazoles > 93662-87-4
93662-87-4 | 1H-Imidazole-2,5-dione, 4-(2-naphthalenyl)-
CAS No: 93662-87-4 Catalog No: AG0061M9 MDL No:
Product Description
Catalog Number:
AG0061M9
Chemical Name:
1H-Imidazole-2,5-dione, 4-(2-naphthalenyl)-
CAS Number:
93662-87-4
Molecular Formula:
C13H8N2O2
Molecular Weight:
224.2148
IUPAC Name:
5-naphthalen-2-ylimidazole-2,4-dione
InChI:
InChI=1S/C13H8N2O2/c16-12-11(14-13(17)15-12)10-6-5-8-3-1-2-4-9(8)7-10/h1-7H,(H,15,16,17)
InChI Key:
AJJFNAYTDITNLQ-UHFFFAOYSA-N
SMILES:
O=C1NC(=O)C(=N1)c1ccc2c(c1)cccc2
Properties
Complexity:
389
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.059g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
224.219g/mol
Monoisotopic Mass:
224.059g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
58.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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