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Overview of (4R,5R)-4-Methyl-5-Phenyl-2-Oxazolidinone

Client Email Product
(4R,5R)-4-methyl-5-phenyl-1,3-oxazolidin-2-one
PharmaCompass
  • Chemistry
(4R,5R)-4-methyl-5-phenyl-1,3-oxazolidin-2-one
Also known as: 125133-96-2, Ac1o73lc, (4r,5r)-4-methyl-5-phenyl-1,3-oxazolidin-2-one, Schembl6374631, Ctk4b4256, Ks-00000dln
Molecular Formula
C10H11NO2
Molecular Weight
177.203  g/mol
InChI Key
PPIBJOQGAJBQDF-APPZFPTMSA-N

1 2D Structure

(4R,5R)-4-methyl-5-phenyl-1,3-oxazolidin-2-one

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(4R,5R)-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-APPZFPTMSA-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 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 125133-96-2

2. Ac1o73lc

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

4. Schembl6374631

5. Ctk4b4256

6. Ks-00000dln

7. Ppibjoqgajbqdf-appzfptmsa-n

8. Zinc155919

9. Akos006306336

10. Zb006136

11. 4alpha-methyl-5beta-phenyloxazolidine-2-one

2.3 Create Date
2006-05-23
3 Chemical and Physical Properties
Molecular Weight 177.203 g/mol
Molecular Formula C10H11NO2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass177.079 g/mol
Monoisotopic Mass177.079 g/mol
Topological Polar Surface Area38.3 A^2
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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