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2D Structure
Also known as: 1719-83-1, 4,4a,8,8a-tetrahydro-4,8-ethenobenzo[1,2-c:4,5-c']difuran-1,3,5,7(3ah,7ah)-tetraone, Bicyclo[2.2.2]oct-7-ene-2,3,5,6-tetracarboxylic acid dianhydride, 4,10-dioxatetracyclo[5.5.2.02,6.08,12]tetradec-13-ene-3,5,9,11-tetrone, 4,4a,8,8a-tetrahydro-4,8-ethenobenzo-[1,2-c:4,5-c']difuran-1,3,5,7(3ah,7ah)-tetraone, 4,8-etheno-1h,3h-benzo[1,2-c:4,5-c']difuran-1,3,5,7-tetrone, 3a,4,4a,7a,8,8a-hexahydro-
Molecular Formula
C12H8O6
Molecular Weight
248.19  g/mol
InChI Key
XLOGCGOPKPCECW-UHFFFAOYSA-N

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
4,10-dioxatetracyclo[5.5.2.02,6.08,12]tetradec-13-ene-3,5,9,11-tetrone
2.1.2 InChI
InChI=1S/C12H8O6/c13-9-5-3-1-2-4(7(5)11(15)17-9)8-6(3)10(14)18-12(8)16/h1-8H
2.1.3 InChI Key
XLOGCGOPKPCECW-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1=CC2C3C(C1C4C2C(=O)OC4=O)C(=O)OC3=O
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 1719-83-1

2. 4,4a,8,8a-tetrahydro-4,8-ethenobenzo[1,2-c:4,5-c']difuran-1,3,5,7(3ah,7ah)-tetraone

3. Bicyclo[2.2.2]oct-7-ene-2,3,5,6-tetracarboxylic Acid Dianhydride

4. 4,10-dioxatetracyclo[5.5.2.02,6.08,12]tetradec-13-ene-3,5,9,11-tetrone

5. 4,4a,8,8a-tetrahydro-4,8-ethenobenzo-[1,2-c:4,5-c']difuran-1,3,5,7(3ah,7ah)-tetraone

6. 4,8-etheno-1h,3h-benzo[1,2-c:4,5-c']difuran-1,3,5,7-tetrone, 3a,4,4a,7a,8,8a-hexahydro-

7. Bicyclo[2.2.2]-7-octene-2,3,5,6-tetracarboxylic Acid Dianhydride

8. Einecs 217-009-2

9. Bicyclo(2.2.2)oct-7-ene-2,3:5,6-tetracarboxylic Dianhydride

10. Schembl671860

11. Dtxsid30938064

12. Bicyclo[2.2.2]-7-octene-2,3,5,6-tetracarboxylic Dianhydride

13. Mfcd00082228

14. Akos008969288

15. Akos025213465

16. Cs-w014110

17. As-73953

18. B1317

19. B4261

20. Ft-0622960

21. D89063

22. A811372

23. Bicyclo[2.2.2]oct-7-ene-2,3,5,6-tetracarboxylic 2,3:5,6-dianhydride

24. Bicyclo[2.2.2]oct-7-ene-2,3,5,6-tetracarboxylic Dianhydride, 99%

25. Hexahydro-1h,3h-4,8-ethenobenzo[1,2-c:4,5-c']difuran-1,3,5,7-tetrone

26. (13e)-4,10-dioxatetracyclo[5.5.2.02,6.08,12]tetradecane-13-ene-3,5,9,11-tetrone

27. 4,4a,8,8a-tetrahydro-4,8-ethenobenzo[1,2-c:4,5-c'']difuran-1,3,5,7(3ah,7ah)-tetraone

28. 9,10-dibromo-9,10-dihydro-4h-benzo(4,5)cyclohepta(1,2-b)thiophene-4-one

29. Bicyclo[2.2.2]oct-7-ene-2,3,5,6-tetracarboxylic Dianhydride (purified By Sublimation)

30. 4,10-dioxatetracyclo[5.5.2.0(2),?.0?,(1)(2)]tetradec-13-ene-3,5,9,11-tetrone

31. 4,6-bis(methylsulfanyl)pyrimidine;bicyclo[2.2.2]oct-7-ene-2,3,5,6-tetracarboxylic Dianhydride

2.3 Create Date
2005-03-27
3 Chemical and Physical Properties
Molecular Weight 248.19 g/mol
Molecular Formula C12H8O6
XLogP3-0.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count0
Exact Mass248.03208797 g/mol
Monoisotopic Mass248.03208797 g/mol
Topological Polar Surface Area86.7 Ų
Heavy Atom Count18
Formal Charge0
Complexity459
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count4
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1