Cas no 823234-71-5 (9-Azabicyclo[4.2.1]non-4-en-3-one, 5-(1-oxopropyl)-, (1S,6R)-)
![9-Azabicyclo[4.2.1]non-4-en-3-one, 5-(1-oxopropyl)-, (1S,6R)- structure](https://ossimg.kuujia.com/scimg/823500/823234-71-5x500.png)
823234-71-5 structure
Product Name:9-Azabicyclo[4.2.1]non-4-en-3-one, 5-(1-oxopropyl)-, (1S,6R)-
CAS No:823234-71-5
MF:C11H15NO2
MW:193.242303133011
CID:693947
PubChem ID:71419096
Update Time:2025-04-19
9-Azabicyclo[4.2.1]non-4-en-3-one, 5-(1-oxopropyl)-, (1S,6R)- Chemical and Physical Properties
Names and Identifiers
-
- 9-Azabicyclo[4.2.1]non-4-en-3-one, 5-(1-oxopropyl)-, (1S,6R)-
- (1S,6R)-5-propanoyl-9-azabicyclo[4.2.1]non-4-en-3-one
- 4-Oxohomoanatoxin-A
- 823234-71-5
- DTXSID80838363
- CHEBI:220718
-
- Inchi： 1S/C11H15NO2/c1-2-11(14)9-6-8(13)5-7-3-4-10(9)12-7/h6-7,10,12H,2-5H2,1H3/t7-,10+/m0/s1
- InChI Key： OQSWFCINTWWZIB-OIBJUYFYSA-N
- SMILES： O=C1C=C(C(CC)=O)[C@H]2CC[C@@H](C1)N2
Computed Properties
- Exact Mass: 193.110278721g/mol
- Monoisotopic Mass: 193.110278721g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 306
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 2
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.1
- Topological Polar Surface Area: 46.2?2
9-Azabicyclo[4.2.1]non-4-en-3-one, 5-(1-oxopropyl)-, (1S,6R)- Related Literature
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
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