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7355-31-9 | 5-pentyl-5-(tetrahydro-2h-pyran-2-yl)imidazolidine-2,4-dione
CAS No: 7355-31-9 Catalog No: AG005MW9 MDL No:
Product Description
Catalog Number:
AG005MW9
Chemical Name:
5-pentyl-5-(tetrahydro-2h-pyran-2-yl)imidazolidine-2,4-dione
CAS Number:
7355-31-9
Molecular Formula:
C13H22N2O3
Molecular Weight:
254.3254
IUPAC Name:
5-(oxan-2-yl)-5-pentylimidazolidine-2,4-dione
InChI:
InChI=1S/C13H22N2O3/c1-2-3-5-8-13(10-7-4-6-9-18-10)11(16)14-12(17)15-13/h10H,2-9H2,1H3,(H2,14,15,16,17)
InChI Key:
AXJUOSFLAYOYQK-UHFFFAOYSA-N
SMILES:
CCCCCC1(NC(=O)NC1=O)C1CCCCO1
NSC Number:
52084
Properties
Complexity:
332
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.163g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
254.33g/mol
Monoisotopic Mass:
254.163g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
67.4A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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