Cas no 281-36-7 (4,6,10-Trioxa-1-azatricyclo[3.3.1.13,7]decane(9CI))
281-36-7 structure
Product Name:4,6,10-Trioxa-1-azatricyclo[3.3.1.13,7]decane(9CI)
4,6,10-Trioxa-1-azatricyclo[3.3.1.13,7]decane(9CI) Chemical and Physical Properties
Names and Identifiers
-
- 4,6,10-Trioxa-1-azatricyclo[3.3.1.13,7]decane(9CI)
- 4,6,10-trioxa-1-aza-adamantane
- AC1L8KPL
- CTK1A3412
- NSC227394
- SCHEMBL11587733
- DTXSID20330230
- 4,6,10-Trioxa-1-azatricyclo[3.3.1.1~3,7~]decane
- NSC-227394
- 281-36-7
-
- Inchi: 1S/C6H9NO3/c1-4-8-5-2-7(1)3-6(9-4)10-5/h4-6H,1-3H2
- InChI Key: KAIOVCWKGLTJGE-UHFFFAOYSA-N
- SMILES: O1C2CN3CC(O2)OC1C3
Computed Properties
- Exact Mass: 143.05827
- Monoisotopic Mass: 143.058
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 10
- Rotatable Bond Count: 0
- Complexity: 123
- 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
- XLogP3: -0.4
- Topological Polar Surface Area: 30.9?2
Experimental Properties
- Density: 1.44
- Boiling Point: 182.8°Cat760mmHg
- Flash Point: 52.2°C
- Refractive Index: 1.574
- PSA: 30.93
4,6,10-Trioxa-1-azatricyclo[3.3.1.13,7]decane(9CI) Related Literature
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
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