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95680-76-5 | 2,4-Imidazolidinedione, 5-(1,5-cyclohexadien-1-yl)-5-phenyl-
CAS No: 95680-76-5 Catalog No: AG006BT3 MDL No:
Product Description
Catalog Number:
AG006BT3
Chemical Name:
2,4-Imidazolidinedione, 5-(1,5-cyclohexadien-1-yl)-5-phenyl-
CAS Number:
95680-76-5
Molecular Formula:
C15H14N2O2
Molecular Weight:
254.2839
IUPAC Name:
5-cyclohexa-1,5-dien-1-yl-5-phenylimidazolidine-2,4-dione
InChI:
InChI=1S/C15H14N2O2/c18-13-15(17-14(19)16-13,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1,3-5,7-10H,2,6H2,(H2,16,17,18,19)
InChI Key:
VKQQYLKPEMKLNI-UHFFFAOYSA-N
SMILES:
O=C1NC(=O)C(N1)(C1=CCCC=C1)c1ccccc1
Properties
Complexity:
461
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.106g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
254.289g/mol
Monoisotopic Mass:
254.106g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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