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139183-82-7 | 2,4-Imidazolidinedione, 1-(1-oxohexadecyl)-5,5-diphenyl-
CAS No: 139183-82-7 Catalog No: AG001AGW MDL No:
Product Description
Catalog Number:
AG001AGW
Chemical Name:
2,4-Imidazolidinedione, 1-(1-oxohexadecyl)-5,5-diphenyl-
CAS Number:
139183-82-7
Molecular Formula:
C31H42N2O3
Molecular Weight:
490.6768
IUPAC Name:
1-hexadecanoyl-5,5-diphenylimidazolidine-2,4-dione
InChI:
InChI=1S/C31H42N2O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-20-25-28(34)33-30(36)32-29(35)31(33,26-21-16-14-17-22-26)27-23-18-15-19-24-27/h14-19,21-24H,2-13,20,25H2,1H3,(H,32,35,36)
InChI Key:
HAPMVTJSQDTAJI-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCC(=O)N1C(=O)NC(=O)C1(c1ccccc1)c1ccccc1
Properties
Complexity:
661
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
490.32g/mol
Formal Charge:
0
Heavy Atom Count:
36
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
490.688g/mol
Monoisotopic Mass:
490.32g/mol
Rotatable Bond Count:
16
Topological Polar Surface Area:
66.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
9.4
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