Cas no 93704-87-1 (2-Oxabicyclo[2.2.2]octane, 1,3-dimethyl-)
93704-87-1 structure
Product Name:2-Oxabicyclo[2.2.2]octane, 1,3-dimethyl-
CAS No:93704-87-1
MF:C9H16O
MW:140.222743034363
CID:735554
PubChem ID:71330055
Update Time:2025-04-19
2-Oxabicyclo[2.2.2]octane, 1,3-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- 2-Oxabicyclo[2.2.2]octane, 1,3-dimethyl-
- 2,4-dimethyl-3-oxabicyclo[2.2.2]octane
- DTXSID80758810
- 1,3-Dimethyl-2-oxabicyclo[2.2.2]octane
- 93704-87-1
- SCHEMBL15778806
-
- Inchi: 1S/C9H16O/c1-7-8-3-5-9(2,10-7)6-4-8/h7-8H,3-6H2,1-2H3
- InChI Key: UHAYVNRWODBYLM-UHFFFAOYSA-N
- SMILES: O1C(C)C2CCC1(C)CC2
Computed Properties
- Exact Mass: 140.120115130g/mol
- Monoisotopic Mass: 140.120115130g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 10
- Rotatable Bond Count: 0
- Complexity: 134
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2
- Topological Polar Surface Area: 9.2?2
2-Oxabicyclo[2.2.2]octane, 1,3-dimethyl- Related Literature
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
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4. Estimating and correcting interference fringes in infrared spectra in infrared hyperspectral imagingGhazal Azarfar,Ebrahim Aboualizadeh,Nicholas M. Walter,Simona Ratti,Camilla Olivieri,Alessandra Norici,Michael Nasse,Achim Kohler,Mario Giordano Analyst, 2018,143, 4674-4683
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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