Cas no 142926-86-1 (1-Propanone,1-(1R,6R)-9-azabicyclo[4.2.1]non-2-en-2-yl-)
![1-Propanone,1-(1R,6R)-9-azabicyclo[4.2.1]non-2-en-2-yl- structure](https://ossimg.kuujia.com/scimg/143000/142926-86-1x500.png)
142926-86-1 structure
Product Name:1-Propanone,1-(1R,6R)-9-azabicyclo[4.2.1]non-2-en-2-yl-
CAS No:142926-86-1
MF:C11H17NO
MW:179.258783102036
CID:170985
PubChem ID:126727
Update Time:2025-04-19
1-Propanone,1-(1R,6R)-9-azabicyclo[4.2.1]non-2-en-2-yl- Chemical and Physical Properties
Names and Identifiers
-
- 1-Propanone,1-(1R,6R)-9-azabicyclo[4.2.1]non-2-en-2-yl-
- 1-[(1R,6R)-9-azabicyclo[4.2.1]non-4-en-5-yl]propan-1-one
- (1R)-1-(9-Azabicyclo(4.2.1)non-2-en-2-yl)-1-propanone
- 1-[(1S,6S)-9-azabicyclo[4.2.1]non-2-en-2-yl]propan-1-one
- 1-Propanone, 1-(9-azabicyclo(4.2.1)non-2-en-2-yl)-, (1R)-
- 2-(Propan-1-oxo-1-yl)-9-azabicyclo(4.2.1)non-2-ene
- Homoanatoxin
- Homoantx
- Homoanatoxin a
- DTXSID00931683
- 142926-86-1
- CHEBI:219576
- Homoanatoxin-a
- 1-[(1R,6R)-9-azabicyclo[4.2.1]non-2-en-2-yl]propan-1-one
-
- Inchi： 1S/C11H17NO/c1-2-11(13)9-5-3-4-8-6-7-10(9)12-8/h5,8,10,12H,2-4,6-7H2,1H3/t8-,10-/m1/s1
- InChI Key： VVMQRZZXKNDPOT-PSASIEDQSA-N
- SMILES： O=C(CC)C1=CCC[C@@H]2CC[C@H]1N2
Computed Properties
- Exact Mass: 179.131
- Monoisotopic Mass: 179.131
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 245
- 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
- Surface Charge: 0
- Tautomer Count: 5
- XLogP3: 1.3
- Topological Polar Surface Area: 29.1?2
Experimental Properties
- Density: 1.019
- Boiling Point: 305.8°Cat760mmHg
- Flash Point: 125.5°C
- Refractive Index: 1.5
1-Propanone,1-(1R,6R)-9-azabicyclo[4.2.1]non-2-en-2-yl- Related Literature
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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N. Soin,D. Boyer,K. Prashanthi,S. Sharma,A. A. Narasimulu,J. Luo,T. H. Shah,E. Siores,T. Thundat Chem. Commun., 2015,51, 8257-8260
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Pavel Karásek,Jakub Grym,Michal Roth,Josef Planeta,Franti?ek Foret Lab Chip, 2015,15, 311-318
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
142926-86-1 (1-Propanone,1-(1R,6R)-9-azabicyclo[4.2.1]non-2-en-2-yl-) Related Products
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