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Home > Imidazoles > 111897-27-9
111897-27-9 | 2,4-Imidazolidinedione, 3-hexyl-5-(phenylmethyl)-
CAS No: 111897-27-9 Catalog No: AG007DFS MDL No:
Product Description
Catalog Number:
AG007DFS
Chemical Name:
2,4-Imidazolidinedione, 3-hexyl-5-(phenylmethyl)-
CAS Number:
111897-27-9
Molecular Formula:
C16H22N2O2
Molecular Weight:
274.3581
IUPAC Name:
5-benzyl-3-hexylimidazolidine-2,4-dione
InChI:
InChI=1S/C16H22N2O2/c1-2-3-4-8-11-18-15(19)14(17-16(18)20)12-13-9-6-5-7-10-13/h5-7,9-10,14H,2-4,8,11-12H2,1H3,(H,17,20)
InChI Key:
GQGZFBSBKKERMK-UHFFFAOYSA-N
SMILES:
CCCCCCN1C(=O)NC(C1=O)Cc1ccccc1
Properties
Complexity:
337
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.168g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
274.364g/mol
Monoisotopic Mass:
274.168g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
49.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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