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89020-94-0 | 2,4-Imidazolidinedione, 5,5-dimethyl-3-[4-[(trifluoromethyl)thio]phenyl]-
CAS No: 89020-94-0 Catalog No: AG0042SF MDL No:
Product Description
Catalog Number:
AG0042SF
Chemical Name:
2,4-Imidazolidinedione, 5,5-dimethyl-3-[4-[(trifluoromethyl)thio]phenyl]-
CAS Number:
89020-94-0
Molecular Formula:
C12H11F3N2O2S
Molecular Weight:
304.2881
IUPAC Name:
5,5-dimethyl-3-[4-(trifluoromethylsulfanyl)phenyl]imidazolidine-2,4-dione
InChI:
InChI=1S/C12H11F3N2O2S/c1-11(2)9(18)17(10(19)16-11)7-3-5-8(6-4-7)20-12(13,14)15/h3-6H,1-2H3,(H,16,19)
InChI Key:
IUQWPUYOWSWICW-UHFFFAOYSA-N
SMILES:
O=C1NC(C(=O)N1c1ccc(cc1)SC(F)(F)F)(C)C
Properties
Complexity:
417
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.049g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
304.287g/mol
Monoisotopic Mass:
304.049g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
74.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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