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Home > Imidazoles > 858206-54-9
858206-54-9 | 5-methyl-5-(thiophen-3-yl)imidazolidine-2,4-dione
CAS No: 858206-54-9 Catalog No: AG01A8T3 MDL No:MFCD16547554
Product Description
Catalog Number:
AG01A8T3
Chemical Name:
5-methyl-5-(thiophen-3-yl)imidazolidine-2,4-dione
CAS Number:
858206-54-9
Molecular Formula:
C8H8N2O2S
Molecular Weight:
196.2263
MDL Number:
MFCD16547554
IUPAC Name:
5-methyl-5-thiophen-3-ylimidazolidine-2,4-dione
InChI:
InChI=1S/C8H8N2O2S/c1-8(5-2-3-13-4-5)6(11)9-7(12)10-8/h2-4H,1H3,(H2,9,10,11,12)
InChI Key:
PUTWZZJHSOQALV-UHFFFAOYSA-N
SMILES:
O=C1NC(=O)C(N1)(C)c1cscc1
NSC Number:
109414
Properties
Complexity:
269
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.031g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
196.224g/mol
Monoisotopic Mass:
196.031g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
86.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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