Cas no 6139-33-9 (5-cyclohexyl-5-propylpyrrolidin-2-one)
6139-33-9 structure
Product Name:5-cyclohexyl-5-propylpyrrolidin-2-one
CAS No:6139-33-9
MF:C13H23NO
MW:209.327823877335
CID:1627195
PubChem ID:201516
Update Time:2025-04-21
5-cyclohexyl-5-propylpyrrolidin-2-one Chemical and Physical Properties
Names and Identifiers
-
- 5-cyclohexyl-5-propylpyrrolidin-2-one
- DTXSID30976941
- 2-Pyrrolidinone, 5-cyclohexyl-5-propyl-
- 5-Cyclohexyl-5-propyl-2-pyrrolidinone
- 6139-33-9
- 2-Cyclohexyl-2-propyl-3,4-dihydro-2H-pyrrol-5-ol
-
- Inchi： 1S/C13H23NO/c1-2-9-13(10-8-12(15)14-13)11-6-4-3-5-7-11/h11H,2-10H2,1H3,(H,14,15)
- InChI Key： BHMFKSCVLGDXQQ-UHFFFAOYSA-N
- SMILES： O=C1CCC(CCC)(C2CCCCC2)N1
Computed Properties
- Exact Mass: 209.17809
- Monoisotopic Mass: 209.178
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 15
- Rotatable Bond Count: 3
- Complexity: 233
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.1
- Topological Polar Surface Area: 29.1?2
Experimental Properties
- Density: 0.978
- Boiling Point: 355.1°C at 760 mmHg
- Flash Point: 213.8°C
- Refractive Index: 1.486
- PSA: 29.1
5-cyclohexyl-5-propylpyrrolidin-2-one Related Literature
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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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3. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
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