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Technical details about (4R,5S)-4-Methyl-5-phenyloxazolidin-2-one, learn more about the structure, uses, toxicity, action, side effects and more

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2D Structure
1. Also known as: 77943-39-6, (4r,5s)-4-methyl-5-phenyloxazolidin-2-one, (4r,5s)-4-methyl-5-phenyl-2-oxazolidinone, (4r,5s)-4-methyl-5-phenyl-1,3-oxazolidin-2-one, 2-oxazolidinone, 4-methyl-5-phenyl-, (4r,5s)-, 05339k0t1y
Molecular Formula
C10H11NO2
Molecular Weight
177.20  g/mol
InChI Key
PPIBJOQGAJBQDF-VXNVDRBHSA-N
FDA UNII
05339K0T1Y

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(4R,5S)-4-methyl-5-phenyl-1,3-oxazolidin-2-one
2.1.2 InChI
InChI=1S/C10H11NO2/c1-7-9(13-10(12)11-7)8-5-3-2-4-6-8/h2-7,9H,1H3,(H,11,12)/t7-,9-/m1/s1
2.1.3 InChI Key
PPIBJOQGAJBQDF-VXNVDRBHSA-N
2.1.4 Canonical SMILES
CC1C(OC(=O)N1)C2=CC=CC=C2
2.1.5 Isomeric SMILES
C[C@@H]1[C@@H](OC(=O)N1)C2=CC=CC=C2
2.2 Other Identifiers
2.2.1 UNII
05339K0T1Y
2.3 Synonyms
2.3.1 MeSH Synonyms

1. 4-methyl-5-phenyl-1,3-oxazolidin-2-one

2. 4-methyl-5-phenyl-1,3-oxazolidin-2-one, (cis-(+-))-isomer

3. Meph-2-oxazolidinone

2.3.2 Depositor-Supplied Synonyms

1. 77943-39-6

2. (4r,5s)-4-methyl-5-phenyloxazolidin-2-one

3. (4r,5s)-4-methyl-5-phenyl-2-oxazolidinone

4. (4r,5s)-4-methyl-5-phenyl-1,3-oxazolidin-2-one

5. 2-oxazolidinone, 4-methyl-5-phenyl-, (4r,5s)-

6. 05339k0t1y

7. 2-oxazolidinone, 4-methyl-5-phenyl-, (4r-cis)-

8. Meph-2-oxazolidinone

9. Mfcd00010845

10. Unii-05339k0t1y

11. 4-methyl-5-phenyl-2-oxazolidinone (4r-cis)-

12. Schembl4291

13. 4-methyl-5-phenyl-2-oxazolidinone, (4r,5s)-

14. (4r,5s)-(-)-4-methyl-5-phenyl-2-oxazolidinone

15. Zinc389617

16. Amy30719

17. Cda94339

18. Akos016843472

19. Cs-w017369

20. Cs-11241

21. Db-075394

22. 4alpha-methyl-5alpha-phenyl-2-oxazolidinone

23. (4r,5s)-4-methyl-5-phenyl-oxazolidin-2-one

24. (4r,5s)-4-methyl-5-phenyl-oxazolidine-2-one

25. 4-(r)-methyl-5-(s)-phenyl-oxazolidin-2-one

26. (4r, 5s)-4-methyl-5-phenyl-oxazolidin-2-one

27. (4r,5s)-4-methyl-5-phenyloxazolidinone

28. (4r,5s)-(+)-4-methyl-5-phenyloxazolidin-2-one

29. 943m396

30. A839298

31. (4r, 5s)-(+)-4-methyl-5-phenyl-2-oxazolidinone

32. A1-00387

33. Q27236062

34. (4r,5s)-(+)-4-methyl-5-phenyl-2-oxazolidinone, 99%

35. (4r,5s)-4-methyl-5-phenyl-oxazolidin-2-one;(4r,5s)-(+)-4-methyl-5-phenyl-2-oxazolidinone

2.4 Create Date
2005-07-19
3 Chemical and Physical Properties
Molecular Weight 177.20 g/mol
Molecular Formula C10H11NO2
XLogP31.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass177.078978594 g/mol
Monoisotopic Mass177.078978594 g/mol
Topological Polar Surface Area38.3 Ų
Heavy Atom Count13
Formal Charge0
Complexity199
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
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