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Home > Imidazoles > 138610-52-3
138610-52-3 | 2,4-Imidazolidinedione, 1-methyl-5-(3-thienylmethylene)-, (E)- (9CI)
CAS No: 138610-52-3 Catalog No: AG0018UR MDL No:
Product Description
Catalog Number:
AG0018UR
Chemical Name:
2,4-Imidazolidinedione, 1-methyl-5-(3-thienylmethylene)-, (E)- (9CI)
CAS Number:
138610-52-3
Molecular Formula:
C9H8N2O2S
Molecular Weight:
208.2370
IUPAC Name:
1-methyl-5-(thiophen-3-ylmethylidene)imidazolidine-2,4-dione
InChI:
InChI=1S/C9H8N2O2S/c1-11-7(8(12)10-9(11)13)4-6-2-3-14-5-6/h2-5H,1H3,(H,10,12,13)
InChI Key:
GYWOXNDSEPPXFR-UHFFFAOYSA-N
SMILES:
O=C1NC(=O)/C(=C\c2cscc2)/N1C
Properties
Complexity:
314
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.031g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
208.235g/mol
Monoisotopic Mass:
208.031g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
77.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
0.9
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