Cas no 22782-68-9 (8-Azatricyclo[4.3.0.02,5]non-3-ene-7,9-dione)
![8-Azatricyclo[4.3.0.02,5]non-3-ene-7,9-dione structure](https://ossimg.kuujia.com/scimg/23000/22782-68-9x500.png)
22782-68-9 structure
Product Name:8-Azatricyclo[4.3.0.02,5]non-3-ene-7,9-dione
CAS No:22782-68-9
MF:C8H7NO2
MW:149.146682024002
CID:268764
PubChem ID:12211563
Update Time:2025-04-19
8-Azatricyclo[4.3.0.02,5]non-3-ene-7,9-dione Chemical and Physical Properties
Names and Identifiers
-
- 8-Azatricyclo[4.3.0.02,5]non-3-ene-7,9-dione
- Bicyclo[2.2.0]hex-5-ene-2,3-dicarboximide(8CI)
- 22782-68-9
- DTXSID80480664
-
- Inchi： 1S/C8H7NO2/c10-7-5-3-1-2-4(3)6(5)8(11)9-7/h1-6H,(H,9,10,11)
- InChI Key： XMNBOGUMTSJKTI-UHFFFAOYSA-N
- SMILES： O=C1C2C(C(N1)=O)C1C=CC12
Computed Properties
- Exact Mass: 149.04771
- Monoisotopic Mass: 149.047678466g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 0
- Complexity: 267
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 4
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -0.5
- Topological Polar Surface Area: 46.2?2
Experimental Properties
- PSA: 46.17
8-Azatricyclo[4.3.0.02,5]non-3-ene-7,9-dione Related Literature
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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