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6969-87-5

6969-87-5 | 2,4-Imidazolidinedione,5-cyclopentyl-5-(1-methylpropyl)-

CAS No: 6969-87-5 Catalog No: AG0068RX MDL No:

Product Description

Catalog Number:
AG0068RX
Chemical Name:
2,4-Imidazolidinedione,5-cyclopentyl-5-(1-methylpropyl)-
CAS Number:
6969-87-5
Molecular Formula:
C12H20N2O2
Molecular Weight:
224.2994
IUPAC Name:
5-butan-2-yl-5-cyclopentylimidazolidine-2,4-dione
InChI:
InChI=1S/C12H20N2O2/c1-3-8(2)12(9-6-4-5-7-9)10(15)13-11(16)14-12/h8-9H,3-7H2,1-2H3,(H2,13,14,15,16)
InChI Key:
DHVVSUYWDAIFLB-UHFFFAOYSA-N
SMILES:
CCC(C1(NC(=O)NC1=O)C1CCCC1)C
NSC Number:
68606

Properties

Complexity:
310  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.152g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
224.304g/mol
Monoisotopic Mass:
224.152g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  

Literature

Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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