Cas no 13090-31-8 (1,5-Diazabicyclo[3.1.0]hexane)
![1,5-Diazabicyclo[3.1.0]hexane structure](https://ossimg.kuujia.com/scimg/13500/13090-31-8x500.png)
1,5-Diazabicyclo[3.1.0]hexane structure
Product Name:1,5-Diazabicyclo[3.1.0]hexane
1,5-Diazabicyclo[3.1.0]hexane Chemical and Physical Properties
Names and Identifiers
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- 1,5-Diazabicyclo[3.1.0]hexane
- InChI=1/C4H8N2/c1-2-5-4-6(5)3-1/h1-4H
- 13090-31-8
- DTXSID60339722
- RZIHIJJOVJRDTA-UHFFFAOYSA-N
-
- Inchi： 1S/C4H8N2/c1-2-5-4-6(5)3-1/h1-4H2
- InChI Key： RZIHIJJOVJRDTA-UHFFFAOYSA-N
- SMILES： N12CCCN1C2
Computed Properties
- Exact Mass: 84.06884
- Monoisotopic Mass: 84.068748264g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 6
- Rotatable Bond Count: 0
- Complexity: 63.9
- 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: 0.5
- Topological Polar Surface Area: 6?2
Experimental Properties
- PSA: 6.02
1,5-Diazabicyclo[3.1.0]hexane Related Literature
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Leonid S. Khaikin,Georgiy G. Ageev,Anatoliy N. Rykov,Olga E. Grikina,Igor F. Shishkov,Igor V. Kochikov,Vladimir V. Kuznetsov,Nina N. Makhova,Sergei S. Bukalov,Larisa A. Leites Phys. Chem. Chem. Phys. 2020 22 22477
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2. A DFT study of Ni-catalyzed (3 + 3)-annulation between donor–acceptor cyclopropanes and diaziridinesSong-Shan Dai,Xiao-jiao Yang,Ran Fang,Alexander M. Kirillov,Lizi Yang Org. Chem. Front. 2023 10 1948
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Nina N. Makhova,Anatolii N. Mikhailyuk,Vladimir V. Kuznetsov,Sergei A. Kutepov,Pavel A. Belyakov Mendeleev Commun. 2000 10 182
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Tanumay Sarkar,Kangkan Talukdar,Subhasish Roy,Tharmalingam Punniyamurthy Chem. Commun. 2020 56 3381
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Sergei N. Denisenko,Paul Rademacher,Remir G. Kostyanovskii Mendeleev Commun. 1998 8 54
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