Cas no 100098-22-4 (1,8-Diazabicyclo[6.3.1]dodecane(9CI))
![1,8-Diazabicyclo[6.3.1]dodecane(9CI) structure](https://ossimg.kuujia.com/scimg/100500/100098-22-4x500.png)
100098-22-4 structure
Product Name:1,8-Diazabicyclo[6.3.1]dodecane(9CI)
CAS No:100098-22-4
MF:C10H20N2
MW:168.279202461243
CID:190479
PubChem ID:145359
Update Time:2025-04-19
1,8-Diazabicyclo[6.3.1]dodecane(9CI) Chemical and Physical Properties
Names and Identifiers
-
- 1,8-Diazabicyclo[6.3.1]dodecane(9CI)
- 1,8-diazabicyclo[6.3.1]dodecane
- 1,8-Diazabicyclo(6.3.1)dodecane
- AC1L3R13
- ACMC-20m36m
- AG-D-04261
- CTK0H9887
- DTXSID80142932
- NS00122273
- DTXSID90869345
- 100098-22-4
-
- Inchi： 1S/C10H20N2/c1-2-4-7-12-9-5-8-11(10-12)6-3-1/h1-10H2
- InChI Key： INBYVNOVCKAAGO-UHFFFAOYSA-N
- SMILES： N12CCCCCCN(CCC1)C2
Computed Properties
- Exact Mass: 168.1628
- Monoisotopic Mass: 168.163
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 122
- 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: 1.7
- Topological Polar Surface Area: 6.5?2
Experimental Properties
- Density: 0.99
- Boiling Point: 231.1°Cat760mmHg
- Flash Point: 86.4°C
- Refractive Index: 1.525
- PSA: 6.48
- LogP: 1.40140
1,8-Diazabicyclo[6.3.1]dodecane(9CI) Related Literature
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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