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86978-86-1 | 2-Selenazolidinone, 5-[(4-methoxyphenyl)methylene]-4-thioxo-
CAS No: 86978-86-1 Catalog No: AG004HFK MDL No:
Product Description
Catalog Number:
AG004HFK
Chemical Name:
2-Selenazolidinone, 5-[(4-methoxyphenyl)methylene]-4-thioxo-
CAS Number:
86978-86-1
Molecular Formula:
C11H9NO2SSe
Molecular Weight:
298.2197
IUPAC Name:
5-[(4-methoxyphenyl)methylidene]-4-sulfanylidene-1,3-selenazolidin-2-one
InChI:
InChI=1S/C11H9NO2SSe/c1-14-8-4-2-7(3-5-8)6-9-10(15)12-11(13)16-9/h2-6H,1H3,(H,12,13,15)
InChI Key:
YKRTWDJJNWLEMB-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)C=C1[Se]C(=O)NC1=S
Properties
Complexity:
335
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.952g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
298.229g/mol
Monoisotopic Mass:
298.952g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
70.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
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