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82085-47-0 | 2,4-Selenazolidinedione,5-[(2,4-dimethoxyphenyl)methylene]-
CAS No: 82085-47-0 Catalog No: AG0052OR MDL No:
Product Description
Catalog Number:
AG0052OR
Chemical Name:
2,4-Selenazolidinedione,5-[(2,4-dimethoxyphenyl)methylene]-
CAS Number:
82085-47-0
Molecular Formula:
C12H11NO4Se
Molecular Weight:
312.1800
IUPAC Name:
5-[(2,4-dimethoxyphenyl)methylidene]-1,3-selenazolidine-2,4-dione
InChI:
InChI=1S/C12H11NO4Se/c1-16-8-4-3-7(9(6-8)17-2)5-10-11(14)13-12(15)18-10/h3-6H,1-2H3,(H,13,14,15)
InChI Key:
IEUQRNOWYVJLPR-UHFFFAOYSA-N
SMILES:
COc1cc(OC)ccc1C=C1[Se]C(=O)NC1=O
Properties
Complexity:
382
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
312.985g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
312.194g/mol
Monoisotopic Mass:
312.985g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
64.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
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