Cas no 141380-34-9 (2,5-Methano-2H-cyclopenta[c]pyridin-4(3H)-one,hexahydro-)
![2,5-Methano-2H-cyclopenta[c]pyridin-4(3H)-one,hexahydro- structure](https://ossimg.kuujia.com/scimg/141500/141380-34-9x500.png)
141380-34-9 structure
Product Name:2,5-Methano-2H-cyclopenta[c]pyridin-4(3H)-one,hexahydro-
CAS No:141380-34-9
MF:C9H13NO
MW:151.205622434616
CID:101697
Update Time:2024-01-24
2,5-Methano-2H-cyclopenta[c]pyridin-4(3H)-one,hexahydro- Chemical and Physical Properties
Names and Identifiers
-
- 2,5-Methano-2H-cyclopenta[c]pyridin-4(3H)-one,hexahydro-
- 2,5-Methano-2H-cyclopenta[c]pyridin-4(3H)-one,hexahydro-(9CI)
- 2,5-Methano-2H-cyclopenta[c]pyridin-4(3H)-one, hexahydro-
-
- Inchi： 1S/C9H13NO/c11-8-5-10-3-6-1-2-7(4-10)9(6)8/h6-7,9H,1-5H2
- InChI Key： HWDSVIYPCSLXDK-UHFFFAOYSA-N
- SMILES： C1N2CC3C(C(=O)C2)C1CC3
Computed Properties
- Exact Mass: 151.1
- Monoisotopic Mass: 151.1
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 0
- Complexity: 200
- 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
- Topological Polar Surface Area: 20.3A^2
Experimental Properties
- Density: 1.19±0.1 g/cm3(Predicted)
- Boiling Point: 248.2±23.0 °C(Predicted)
- pka: 6.54±0.20(Predicted)
2,5-Methano-2H-cyclopenta[c]pyridin-4(3H)-one,hexahydro- Related Literature
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Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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Robert J. Meagher,Anson V. Hatch,Ronald F. Renzi,Anup K. Singh Lab Chip, 2008,8, 2046-2053
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
141380-34-9 (2,5-Methano-2H-cyclopenta[c]pyridin-4(3H)-one,hexahydro-) Related Products
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