Cas no 63330-88-1 (2,8,9-Trioxa-5-aza-1-silabicyclo[3.3.3]undecane, 1-ethynyl-)
![2,8,9-Trioxa-5-aza-1-silabicyclo[3.3.3]undecane, 1-ethynyl- structure](https://ossimg.kuujia.com/scimg/63500/63330-88-1x500.png)
63330-88-1 structure
Product Name:2,8,9-Trioxa-5-aza-1-silabicyclo[3.3.3]undecane, 1-ethynyl-
CAS No:63330-88-1
MF:C8H13NO3Si
MW:199.279223203659
CID:426770
PubChem ID:12491747
Update Time:2025-04-19
2,8,9-Trioxa-5-aza-1-silabicyclo[3.3.3]undecane, 1-ethynyl- Chemical and Physical Properties
Names and Identifiers
-
- 2,8,9-Trioxa-5-aza-1-silabicyclo[3.3.3]undecane, 1-ethynyl-
- 5-ethynyl-4,6,11-trioxa-1-aza-5-silabicyclo[3.3.3]undecane
- SURKHQOLKCJLSC-UHFFFAOYSA-
- 1-Ethynyl-2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undecane
- InChI=1/C8H13NO3Si/c1-2-13-10-6-3-9(4-7-11-13)5-8-12-13/h1H,3-8H2
- DTXSID50500247
- 63330-88-1
-
- Inchi： 1S/C8H13NO3Si/c1-2-13-10-6-3-9(4-7-11-13)5-8-12-13/h1H,3-8H2
- InChI Key： SURKHQOLKCJLSC-UHFFFAOYSA-N
- SMILES： [Si]12(C#C)OCCN(CCO1)CCO2
Computed Properties
- Exact Mass: 199.06649
- Monoisotopic Mass: 199.06646981g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 210
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 30.9?2
Experimental Properties
- PSA: 30.93
- LogP: -0.58540
2,8,9-Trioxa-5-aza-1-silabicyclo[3.3.3]undecane, 1-ethynyl- Related Literature
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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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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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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