Cas no 61589-00-2 (2-Azaspiro[4.5]decane, 2-(3-chlorophenyl)-)
61589-00-2 structure
Product Name:2-Azaspiro[4.5]decane, 2-(3-chlorophenyl)-
CAS No:61589-00-2
MF:C15H20ClN
MW:249.779003143311
CID:473765
PubChem ID:12291998
Update Time:2025-04-19
2-Azaspiro[4.5]decane, 2-(3-chlorophenyl)- Chemical and Physical Properties
Names and Identifiers
-
- 2-Azaspiro[4.5]decane, 2-(3-chlorophenyl)-
- 2-(3-chlorophenyl)-2-azaspiro[4.5]decane
- 61589-00-2
- DTXSID00485050
-
- Inchi: 1S/C15H20ClN/c16-13-5-4-6-14(11-13)17-10-9-15(12-17)7-2-1-3-8-15/h4-6,11H,1-3,7-10,12H2
- InChI Key: QJMBIZNQQQHQEO-UHFFFAOYSA-N
- SMILES: ClC1=CC=CC(=C1)N1CCC2(C1)CCCCC2
Computed Properties
- Exact Mass: 249.1286
- Monoisotopic Mass: 249.1284273g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 17
- Rotatable Bond Count: 1
- Complexity: 260
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 5
- Topological Polar Surface Area: 3.2?2
Experimental Properties
- PSA: 3.24
2-Azaspiro[4.5]decane, 2-(3-chlorophenyl)- Related Literature
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P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
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2. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
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Ni-Na Sun,Fengli Qu,Xiaobing Zhang,Shufang Zhang,Jinmao You Analyst, 2015,140, 1827-1831
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