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Chemistry

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Also known as: 116496-76-5, N-(2-ethoxy-4-nitrophenyl)acetamide, Acetamide,n-(2-ethoxy-4-nitrophenyl)-, 2'-ethoxy-4'-nitroacetanilide, Cds1_004703, Cbmicro_030367
Molecular Formula
C10H12N2O4
Molecular Weight
224.21  g/mol
InChI Key
XZWVZJDHIDYKPB-UHFFFAOYSA-N

Sotatercept
1 2D Structure

Sotatercept

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
N-(2-ethoxy-4-nitrophenyl)acetamide
2.1.2 InChI
InChI=1S/C10H12N2O4/c1-3-16-10-6-8(12(14)15)4-5-9(10)11-7(2)13/h4-6H,3H2,1-2H3,(H,11,13)
2.1.3 InChI Key
XZWVZJDHIDYKPB-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CCOC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 116496-76-5

2. N-(2-ethoxy-4-nitrophenyl)acetamide

3. Acetamide,n-(2-ethoxy-4-nitrophenyl)-

4. 2'-ethoxy-4'-nitroacetanilide

5. Cds1_004703

6. Cbmicro_030367

7. Oprea1_342150

8. Divk1c_005743

9. Schembl2204761

10. Dtxsid60387001

11. Zinc5061120

12. Mfcd00994990

13. Akos001044796

14. Ab07920

15. Ps-6223

16. Bim-0030123.p001

17. Db-049909

18. Ft-0715219

19. Sr-01000223946

20. Sr-01000223946-1

21. 4-(4-ethoxycarbonylthiazol-2-yl)piperazine-1-carboxylic Acid Tert-butyl Ester

2.3 Create Date
2005-07-29
3 Chemical and Physical Properties
Molecular Weight 224.21 g/mol
Molecular Formula C10H12N2O4
XLogP31.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass224.07970687 g/mol
Monoisotopic Mass224.07970687 g/mol
Topological Polar Surface Area84.2 Ų
Heavy Atom Count16
Formal Charge0
Complexity264
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

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