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6325-66-2 | 5-(4-Ethoxy-benzylidene)-imidazolidine-2,4-dione
CAS No: 6325-66-2 Catalog No: AG01672U MDL No:
Product Description
Catalog Number:
AG01672U
Chemical Name:
5-(4-Ethoxy-benzylidene)-imidazolidine-2,4-dione
CAS Number:
6325-66-2
Molecular Formula:
C12H12N2O3
Molecular Weight:
232.2353
IUPAC Name:
5-[(4-ethoxyphenyl)methylidene]imidazolidine-2,4-dione
InChI:
InChI=1S/C12H12N2O3/c1-2-17-9-5-3-8(4-6-9)7-10-11(15)14-12(16)13-10/h3-7H,2H2,1H3,(H2,13,14,15,16)
InChI Key:
LFSSBGHCUOEEOQ-UHFFFAOYSA-N
SMILES:
CCOc1ccc(cc1)/C=C/1\NC(=O)NC1=O
Properties
Complexity:
344
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.085g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
232.239g/mol
Monoisotopic Mass:
232.085g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
67.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.4
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