Cas no 87689-20-1 (1,6-Diazabicyclo[3.1.0]hexane, 6-chloro-)
![1,6-Diazabicyclo[3.1.0]hexane, 6-chloro- structure](https://ossimg.kuujia.com/scimg/88000/87689-20-1x500.png)
87689-20-1 structure
Product Name:1,6-Diazabicyclo[3.1.0]hexane, 6-chloro-
CAS No:87689-20-1
MF:C4H7ClN2
MW:118.564779520035
CID:653476
PubChem ID:13147404
Update Time:2025-04-19
1,6-Diazabicyclo[3.1.0]hexane, 6-chloro- Chemical and Physical Properties
Names and Identifiers
-
- 1,6-Diazabicyclo[3.1.0]hexane, 6-chloro-
- 6-chloro-5,6-diazabicyclo[3.1.0]hexane
- 87689-20-1
- 6-Chloro-1,6-diazabicyclo[3.1.0]hexane
- DTXSID40521961
-
- Inchi： 1S/C4H7ClN2/c5-7-4-2-1-3-6(4)7/h4H,1-3H2
- InChI Key： FWQZKQBYUMWDRD-UHFFFAOYSA-N
- SMILES： ClN1C2CCCN12
Computed Properties
- Exact Mass: 118.0297759g/mol
- Monoisotopic Mass: 118.0297759g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 7
- Rotatable Bond Count: 0
- Complexity: 95.7
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.3
- Topological Polar Surface Area: 6?2
1,6-Diazabicyclo[3.1.0]hexane, 6-chloro- Related Literature
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Jieun Kim,Han-Saem Park,Tae-Hee Kim,Sung Yeol Kim,Hyun-Kon Song Phys. Chem. Chem. Phys., 2014,16, 5295-5300
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Benjamin Gabriel Poulson,Kacper Szczepski,Joanna Izabela Lachowicz,Lukasz Jaremko,Abdul-Hamid Emwas,Mariusz Jaremko RSC Adv., 2020,10, 215-227
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
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Xiaofeng Lin RSC Adv., 2016,6, 9002-9006
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