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Home > Imidazoles > 91559-39-6
91559-39-6 | 5-(2,4-Dimethoxy-benzylidene)-imidazolidine-2,4-dione
CAS No: 91559-39-6 Catalog No: AG01672W MDL No:
Product Description
Catalog Number:
AG01672W
Chemical Name:
5-(2,4-Dimethoxy-benzylidene)-imidazolidine-2,4-dione
CAS Number:
91559-39-6
Molecular Formula:
C12H12N2O4
Molecular Weight:
248.2347
IUPAC Name:
(5E)-5-[(2,4-dimethoxyphenyl)methylidene]imidazolidine-2,4-dione
InChI:
InChI=1S/C12H12N2O4/c1-17-8-4-3-7(10(6-8)18-2)5-9-11(15)14-12(16)13-9/h3-6H,1-2H3,(H2,13,14,15,16)/b9-5+
InChI Key:
QWZOWAQJPHWMTR-WEVVVXLNSA-N
SMILES:
COc1cc(OC)ccc1/C=C/1\NC(=O)NC1=O
Properties
Complexity:
380
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
248.08g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
248.238g/mol
Monoisotopic Mass:
248.08g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
76.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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