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Technical details about Oxazolidine-2,5-Dione, learn more about the structure, uses, toxicity, action, side effects and more

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$ API Ref.Price (USD/KG) : 35,370Xls
2D Structure
Also known as: 2,5-oxazolidinedione, 2185-00-4, 1,3-oxazolidine-2,5-dione, Oxazolidin-2,5-dione, 9v6987y758, Einecs 218-570-6
Molecular Formula
C3H3NO3
Molecular Weight
101.06  g/mol
InChI Key
ARAFEULRMHFMDE-UHFFFAOYSA-N
FDA UNII
9V6987Y758

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
1,3-oxazolidine-2,5-dione
2.1.2 InChI
InChI=1S/C3H3NO3/c5-2-1-4-3(6)7-2/h1H2,(H,4,6)
2.1.3 InChI Key
ARAFEULRMHFMDE-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1C(=O)OC(=O)N1
2.2 Other Identifiers
2.2.1 UNII
9V6987Y758
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. 2,5-oxazolidinedione

2. 2185-00-4

3. 1,3-oxazolidine-2,5-dione

4. Oxazolidin-2,5-dione

5. 9v6987y758

6. Einecs 218-570-6

7. 2,5-oxazolidinedione, 98%

8. Schembl166196

9. Dtxsid80176257

10. Unii-9v6987y758

11. Zinc8100959

12. Mfcd00075543

13. Akos006220756

14. Cs-w011320

15. As-38192

16. Ft-0691464

17. A815694

2.4 Create Date
2005-08-08
3 Chemical and Physical Properties
Molecular Weight 101.06 g/mol
Molecular Formula C3H3NO3
XLogP3-0.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass101.011292958 g/mol
Monoisotopic Mass101.011292958 g/mol
Topological Polar Surface Area55.4 Ų
Heavy Atom Count7
Formal Charge0
Complexity119
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1