Cas no 93781-93-2 (1,4-Diazabicyclo[2.2.1]heptane-2,7-dione,3,3-dimethyl-)
![1,4-Diazabicyclo[2.2.1]heptane-2,7-dione,3,3-dimethyl- structure](https://ossimg.kuujia.com/scimg/94000/93781-93-2x500.png)
93781-93-2 structure
Product Name:1,4-Diazabicyclo[2.2.1]heptane-2,7-dione,3,3-dimethyl-
CAS No:93781-93-2
MF:C7H10N2O2
MW:154.166501522064
CID:801590
PubChem ID:45099408
Update Time:2025-04-19
1,4-Diazabicyclo[2.2.1]heptane-2,7-dione,3,3-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- 1,4-Diazabicyclo[2.2.1]heptane-2,7-dione,3,3-dimethyl-
- 1,4-Diazabicyclo[2.2.1]heptane-2,7-dione,3,3-dimethyl-(9CI)
- 3,3-dimethyl-1,4-diazabicyclo[2.2.1]heptane-2,7-dione
- 93781-93-2
- DTXSID20667871
-
- Inchi： 1S/C7H10N2O2/c1-7(2)5(10)8-3-4-9(7)6(8)11/h3-4H2,1-2H3
- InChI Key： NWGMDMYBTSINEY-UHFFFAOYSA-N
- SMILES： O=C1C(C)(C)N2C(N1CC2)=O
Computed Properties
- Exact Mass: 154.074
- Monoisotopic Mass: 154.074
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 0
- Complexity: 247
- 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
- Topological Polar Surface Area: 40.6A^2
- XLogP3: -0.3
1,4-Diazabicyclo[2.2.1]heptane-2,7-dione,3,3-dimethyl- Related Literature
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Dhamodaran Manikandan,S. Amirthapandian,I. S. Zhidkov,A. I. Kukharenko,S. O. Cholakh,Ramaswamy Murugan Phys. Chem. Chem. Phys., 2018,20, 6500-6514
-
Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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