Cas no 117221-80-4 (2H-1b,4-Ethanopentaleno[1,2-b]oxirene,hexahydro-, (1aa,1bb,4b,4aa,5aa)- (9CI))
![2H-1b,4-Ethanopentaleno[1,2-b]oxirene,hexahydro-, (1aa,1bb,4b,4aa,5aa)- (9CI) structure](https://ossimg.kuujia.com/scimg/117500/117221-80-4x500.png)
117221-80-4 structure
Product Name:2H-1b,4-Ethanopentaleno[1,2-b]oxirene,hexahydro-, (1aa,1bb,4b,4aa,5aa)- (9CI)
CAS No:117221-80-4
MF:C10H14O
MW:150.217563152313
CID:131523
PubChem ID:565026
Update Time:2025-04-19
2H-1b,4-Ethanopentaleno[1,2-b]oxirene,hexahydro-, (1aa,1bb,4b,4aa,5aa)- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- 2H-1b,4-Ethanopentaleno[1,2-b]oxirene,hexahydro-, (1aa,1bb,4b,4aa,5aa)- (9CI)
- 2H-1b,4-Ethanopentaleno[1,2-b]oxirene, hexahydro-, (1a-alpha-,1b-bta-,4-bta-,4a-alpha-,5a-alpha-)- (9CI)
- 2H-1b,4-Ethanopentaleno[1,2-b]oxirene, hexahydro-, (1a-alpha-,1b-bta-,4-bta-,4a-alpha-,5a-alpha-)- (9CI)
- JAUNSKPQYMPJOJ-UHFFFAOYSA-N
- 3-oxatetracyclo[5.2.2.01,6.02,4]undecane
- 117221-80-4
- 2H-1b,4-Ethanopentaleno[1,2-b]oxirene, hexahydro-, (1a.alpha.,1b.beta.,4.beta.,4a.alpha.,5a.alpha.)-
- 2H-1b,4-Ethanopentaleno[1,2-b]oxirene, hexahydro-, (1a-alpha-,1b-bta-,4-bta-,4a-alpha-,5a-alpha-)-
-
- Inchi： 1S/C10H14O/c1-3-10-4-2-6(1)7(10)5-8-9(10)11-8/h6-9H,1-5H2
- InChI Key： JAUNSKPQYMPJOJ-UHFFFAOYSA-N
- SMILES： O1C2CC3C4CCC3(CC4)C12
Computed Properties
- Exact Mass: 272.08309
- Monoisotopic Mass: 150.104465066g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 11
- Rotatable Bond Count: 0
- Complexity: 215
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 3
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.1
- Topological Polar Surface Area: 12.5?2
Experimental Properties
- PSA: 52.54
2H-1b,4-Ethanopentaleno[1,2-b]oxirene,hexahydro-, (1aa,1bb,4b,4aa,5aa)- (9CI) Related Literature
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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