Cas no 85514-42-7 (1-(9-azabicyclo[4.2.1]non-2-en-2-yl)-Ethanone)
![1-(9-azabicyclo[4.2.1]non-2-en-2-yl)-Ethanone structure](https://ossimg.kuujia.com/scimg/86000/85514-42-7x500.png)
85514-42-7 structure
Product Name:1-(9-azabicyclo[4.2.1]non-2-en-2-yl)-Ethanone
CAS No:85514-42-7
MF:C10H15NO
MW:165.232202768326
CID:1119115
PubChem ID:431734
Update Time:2025-04-20
1-(9-azabicyclo[4.2.1]non-2-en-2-yl)-Ethanone Chemical and Physical Properties
Names and Identifiers
-
- 1-(9-azabicyclo[4.2.1]non-2-en-2-yl)-Ethanone
- Ethanone, 1-(9-azabicyclo[4.2.1]non-2-en-2-yl)- (9CI)
- CHEMBL25619
- Ethanone, 1-(9-azabicyclo(4.2.1)non-2-en-2-yl)-, (1R)-
- (+)-Anatoxin
- SGNXVBOIDPPRJJ-UHFFFAOYSA-N
- 85514-42-7
- Q3303006
- NCGC00162392-02
- SureCN160708
- AC1L8S0X
- DTXSID301338831
- 2-acetyl-9-azabicyclo[4.2.1]non-2-ene
- 1-(9-Aza-bicyclo[4.2.1]non-2-en-2-yl)-ethanone
- NCGC00162392-01
- C10841
- Anatoxin A
- 1-(9-azabicyclo[4.2.1]non-2-en-2-yl)ethanone
- Anatoxin-A,(+)
- CHEBI:2706
- BDBM50023330
- 2-acetyl-9-azabicyclo [4.2.1]non-2-ene
- 1-(9-azabicyclo[4.2.1]non-4-en-5-yl)ethanone
- SCHEMBL160708
- Anatoxin-a
- Ethanone,1-(9-azabicyclo[4.2.1]non-2-en-2-yl)-(9ci)
- (+/-)-2-ACETYL-9-AZABICYCLO[4.2.1]NON-2-ENEFUMARATE
-
- Inchi： 1S/C10H15NO/c1-7(12)9-4-2-3-8-5-6-10(9)11-8/h4,8,10-11H,2-3,5-6H2,1H3
- InChI Key： SGNXVBOIDPPRJJ-UHFFFAOYSA-N
- SMILES： O=C(C)C1=CCCC2CCC1N2
Computed Properties
- Exact Mass: 165.115364102g/mol
- Monoisotopic Mass: 165.115364102g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 232
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.8
- Topological Polar Surface Area: 29.1?2
1-(9-azabicyclo[4.2.1]non-2-en-2-yl)-Ethanone Related Literature
-
Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
-
Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
-
M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
-
Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
85514-42-7 (1-(9-azabicyclo[4.2.1]non-2-en-2-yl)-Ethanone) Related Products
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