Cas no 17812-41-8 (8-ethyl-8-methyl-8-azoniabicyclo[3.2.1]octan-3-ol;iodide)
17812-41-8 structure
Product Name:8-ethyl-8-methyl-8-azoniabicyclo[3.2.1]octan-3-ol;iodide
CAS No:17812-41-8
MF:C10H20INO
MW:297.176375389099
CID:1371807
PubChem ID:13710639
Update Time:2025-04-20
8-ethyl-8-methyl-8-azoniabicyclo[3.2.1]octan-3-ol;iodide Chemical and Physical Properties
Names and Identifiers
-
- NSC72856
- AGN-PC-00NNT6
- 8syn-ethyl-3endo-hydroxy-8anti-methyl-nortropanium, iodide
- 8syn-Aethyl-3endo-hydroxy-8anti-methyl-nortropanium, Jodid
- 8-Azoniabicyclo[3.2.1]octane, 8-ethyl-3-hydroxy-8-methyl-, iodide
- 8-ethyl-8-methyl-8-azoniabicyclo[3.2.1]octan-3-ol,iodide
- 8-ethyl-8-methyl-8-azoniabicyclo[3.2.1]octan-3-ol
- iodide
- NSC-72856
- 17812-41-8
- 8-Ethyl-3-hydroxy-8-methyl-8-azabicyclo[3.2.1]octan-8-ium iodide
- DTXSID00547384
- 8-ethyl-8-methyl-8-azoniabicyclo[3.2.1]octan-3-ol;iodide
-
- Inchi: 1S/C10H20NO.HI/c1-3-11(2)8-4-5-9(11)7-10(12)6-8;/h8-10,12H,3-7H2,1-2H3;1H/q+1;/p-1
- InChI Key: VQKZQMNGNDTOMT-UHFFFAOYSA-M
- SMILES: [I-].OC1CC2CCC(C1)[N+]2(C)CC
Computed Properties
- Exact Mass: 170.1546
- Monoisotopic Mass: 297.058957
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 167
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 20.2
Experimental Properties
- Boiling Point: °Cat760mmHg
- Flash Point: °C
- PSA: 20.23
- LogP: -1.89860
8-ethyl-8-methyl-8-azoniabicyclo[3.2.1]octan-3-ol;iodide Related Literature
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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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Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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5. 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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