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Home > Imidazoles > 96040-47-0
96040-47-0 | 2,4-Imidazolidinedione, 5-methyl-3-[2-(2-methylphenyl)ethyl]-
CAS No: 96040-47-0 Catalog No: AG006SRB MDL No:
Product Description
Catalog Number:
AG006SRB
Chemical Name:
2,4-Imidazolidinedione, 5-methyl-3-[2-(2-methylphenyl)ethyl]-
CAS Number:
96040-47-0
Molecular Formula:
C13H16N2O2
Molecular Weight:
232.2783
IUPAC Name:
5-methyl-3-[2-(2-methylphenyl)ethyl]imidazolidine-2,4-dione
InChI:
InChI=1S/C13H16N2O2/c1-9-5-3-4-6-11(9)7-8-15-12(16)10(2)14-13(15)17/h3-6,10H,7-8H2,1-2H3,(H,14,17)
InChI Key:
PNTLPPLBJBKNPN-UHFFFAOYSA-N
SMILES:
CC1NC(=O)N(C1=O)CCc1ccccc1C
Properties
Complexity:
317
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.121g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
232.283g/mol
Monoisotopic Mass:
232.121g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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