Cas no 31023-92-4 (1-Azabicyclo[3.3.3]undecane(9CI))
31023-92-4 structure
Product Name:1-Azabicyclo[3.3.3]undecane(9CI)
1-Azabicyclo[3.3.3]undecane(9CI) Chemical and Physical Properties
Names and Identifiers
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- 1-Azabicyclo[3.3.3]undecane(9CI)
- 1-azabicyclo[3.3.3]undecane
- 1-Azabicyclo(3.3.3)undecane
- SCHEMBL1088136
- DTXSID60184996
- 31023-92-4
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- Inchi: 1S/C10H19N/c1-4-10-5-2-8-11(7-1)9-3-6-10/h10H,1-9H2
- InChI Key: WKPGJLQHSAOQEL-UHFFFAOYSA-N
- SMILES: N12CCCC(CCC1)CCC2
Computed Properties
- Exact Mass: 153.15187
- Monoisotopic Mass: 153.152
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 11
- Rotatable Bond Count: 0
- Complexity: 98.3
- 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: 2.2
- Topological Polar Surface Area: 3.2?2
Experimental Properties
- Density: 0.93
- Boiling Point: 213.7°C at 760 mmHg
- Flash Point: 75.2°C
- Refractive Index: 1.5
- PSA: 3.24
1-Azabicyclo[3.3.3]undecane(9CI) Related Literature
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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
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Xue-Ying Wang,Ying Pei,Min Xie,Zi-He Jin,Ya-Shi Xiao,Yang Wang,Li-Na Zhang,Yan Li,Wei-Hua Huang Lab Chip, 2015,15, 1178-1187
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Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
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Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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