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5,5-bis[(2,3,4,5,6-²H?)phenyl]imidazolidine-2,4-dione

5,5-bis[(2,3,4,5,6-²H?)phenyl]imidazolidine-2,4-dione

CAS: 65854-97-9

Formula: C15H12N2O2

SMILES: [2H]C1=C([2H])C([2H])=C(C([2H])=C1[2H])C1(NC(=O)NC1=O)C1=C([2H])C([2H])=C([2H])C([2H])=C1[2H]

IUPAC: 5,5-bis[(2,3,4,5,6-²H?)phenyl]imidazolidine-2,4-dione

InChI: InChI=1S/C15H12N2O2/c18-13-15(17-14(19)16-13,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H,(H2,16,17,18,19)/i1D,2D,3D,4D,5D,6D,7D,8D,9D,10D

Composition: C (68.68%), H (0.77%), [2H] (7.68%), N (10.68%), O (12.20%)

Molar Mass: 262.334

Atom Count: 31

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 262.152645093
Formal Charge 0
FSP3 0.07
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey CXOFVDLJLONNDW-LHNTUAQVSA-N
Lipinski's Rule of Five 1
Molar Refractivity 70.18
Topological Polar Surface Area 58.2
Polarizability 27.12
Ring Count 3
Rotatable Bond Count 2

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