Cas no 6139-31-7 (5-cyclohexyl-5-methylpyrrolidin-2-one)
6139-31-7 structure
Product Name:5-cyclohexyl-5-methylpyrrolidin-2-one
CAS No:6139-31-7
MF:C11H19NO
MW:181.274663209915
CID:1628101
PubChem ID:201514
Update Time:2025-04-21
5-cyclohexyl-5-methylpyrrolidin-2-one Chemical and Physical Properties
Names and Identifiers
-
- 5-cyclohexyl-5-methylpyrrolidin-2-one
- 5-Cyclohexyl-5-methyl-2-pyrrolidinone
- 2-Cyclohexyl-2-methyl-3,4-dihydro-2H-pyrrol-5-ol
- 2-Pyrrolidinone, 5-cyclohexyl-5-methyl-
- DTXSID60976939
- 6139-31-7
-
- Inchi： 1S/C11H19NO/c1-11(8-7-10(13)12-11)9-5-3-2-4-6-9/h9H,2-8H2,1H3,(H,12,13)
- InChI Key： MOZWSOGYOUQJSF-UHFFFAOYSA-N
- SMILES： O=C1CCC(C)(C2CCCCC2)N1
Computed Properties
- Exact Mass: 181.14677
- Monoisotopic Mass: 181.147
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 208
- 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: 2.2
- Topological Polar Surface Area: 29.1?2
Experimental Properties
- Density: 1.008
- Boiling Point: 327.2°C at 760 mmHg
- Flash Point: 193.5°C
- Refractive Index: 1.493
- PSA: 29.1
5-cyclohexyl-5-methylpyrrolidin-2-one Related Literature
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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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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