CAS 253265-97-3

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3 Suppliers, 3 End Use APIs, 21 Related Intermediates

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3 End Use APIs
21 Related Intermediates

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Also known as: 253265-97-3, [(3r,3as,6ar)-hydroxyhexahydrofuro[2,3-b]furanyl succinimidyl carbonate, 14ey0qm9ce, [(3as,4r,6ar)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] (2,5-dioxopyrrolidin-1-yl) carbonate, [(3r,3as,6ar)-hydroxyhexahydrofuro[2,3-, A]furanyl succinimidyl carbonate

Molecular Formula

C₁₁H₁₃NO₇

Molecular Weight

271.22 g/mol

InChI Key

VCFNCYVHQSHFRH-MHYGZLNHSA-N

FDA UNII

14EY0QM9CE

1 2D Structure

CAS 253265-97-3

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

[(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] (2,5-dioxopyrrolidin-1-yl) carbonate

2.1.2 InChI

InChI=1S/C11H13NO7/c13-8-1-2-9(14)12(8)19-11(15)18-7-5-17-10-6(7)3-4-16-10/h6-7,10H,1-5H2/t6-,7-,10+/m0/s1

2.1.3 InChI Key

VCFNCYVHQSHFRH-MHYGZLNHSA-N

2.1.4 Canonical SMILES

C1COC2C1C(CO2)OC(=O)ON3C(=O)CCC3=O

2.1.5 Isomeric SMILES

C1CO[C@H]2[C@@H]1[C@H](CO2)OC(=O)ON3C(=O)CCC3=O

2.2 Other Identifiers

2.2.1 UNII

14EY0QM9CE

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. 253265-97-3

2. [(3r,3as,6ar)-hydroxyhexahydrofuro[2,3-b]furanyl Succinimidyl Carbonate

3. 14ey0qm9ce

4. [(3as,4r,6ar)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] (2,5-dioxopyrrolidin-1-yl) Carbonate

5. [(3r,3as,6ar)-hydroxyhexahydrofuro[2,3-

6. A]furanyl Succinimidyl Carbonate

7. [(3r,3as,6ar)-hexahydrofuro[2,3-b]furan-3-yl] (2,5-dioxopyrrolidin-1-yl) Carbonate

8. 2,5-dioxopyrrolidin-1-yl ((3r,3as,6ar)-hexahydrofuro(2,3-b)furan-3-yl) Carbonate

9. Carbonic Acid, 2,5-dioxo-1-pyrrolidinyl ((3r,3as,6ar)-hexahydrofuro(2,3-b)furan-3-yl) Ester

10. Carbonic Acid, 2,5-dioxo-1-pyrrolidinyl [(3r,3as,6ar)-hexahydrofuro[2,3-b]furan-3-yl] Ester

11. Unii-14ey0qm9ce

12. Schembl829342

13. Dtxsid201021089

14. Bcp09451

15. Mfcd12031467

16. Zinc72399940

17. [(3r,3as,6ar)-hydroxyhexahydrofuro[2,3-?]furanyl Succinimidyl Carbonate

18. Akos022184891

19. Ds-3968

20. Carbonic Acid 2,5-dioxo-1-pyrrolidinyl [(3r,3as,6ar)-hexahydrofuro[2,3-b]furan-3-yl] Ester

21. Ac-26987

22. Cs-0021268

23. F12132

24. A877624

25. A1-24388

26. J-502688

27. (3r,3as,6ar)-hydroxyhexahydrofuro[2,3-b]furanyl Succinimidyl Carbonate

28. 1-([[(3r,3as,6ar)hexahydrofuro[2,3-b]furan-3-yloxy]-carbonyl]oxy)-2,5-pyrrolidinedione

29. 1-([[(3r,3as,6ar)hexahydrofuro[2,3-b]furan-3-yloxy]carbonyl]oxy)-2,5-pyrrolidinedione

30. 2,5-dioxo-1-pyrrolidyl [(3r,3as,6ar)-hexahydrofuro[2,3-b]furan-3-yl] Carbonate

31. 2,5-dioxopyrrolidin-1-yl((3r,3as,6ar)-hexahydrofuro[2,3-b]furan-3-yl)carbonate

32. Carbonic Acid (3r,3abeta,6abeta)-hexahydrofuro[2,3-b]furan-3alpha-yl 2,5-dioxopyrrolizino

33. Carbonic Acid 2,5-dioxo-1-pyrrolidinyl [(3r,3as,6ar)-hexahydrofuro[2,3-b]furan-3-yl] Ester; 2,5-pyrrolidinedione,1-[[[[(3r,3as,6ar)-hexahydrofuro[2,3-b]furan-3-yl]oxy]carbonyl]oxy]- (9ci)

2.4 Create Date

2006-10-26

3 Chemical and Physical Properties

Molecular Formula	C₁₁H₁₃NO₇
Molecular Weight	271.22 g/mol
XLogP3	-0.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	4
Exact Mass	271.06920175 g/mol
Monoisotopic Mass	271.06920175 g/mol
Topological Polar Surface Area	91.4 Å²
Heavy Atom Count	19
Formal Charge	0
Complexity	407
Isotope Atom Count	0
Defined Atom Stereocenter Count	3
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1