Cas no 55110-12-8 (Cyclohexanone, 2-(3-oxo-2-phenylbutyl)-)
55110-12-8 structure
Product Name:Cyclohexanone, 2-(3-oxo-2-phenylbutyl)-
CAS No:55110-12-8
MF:C16H20O2
MW:244.328804969788
CID:352822
PubChem ID:71364308
Update Time:2025-04-19
Cyclohexanone, 2-(3-oxo-2-phenylbutyl)- Chemical and Physical Properties
Names and Identifiers
-
- Cyclohexanone, 2-(3-oxo-2-phenylbutyl)-
- 2-(3-oxo-2-phenylbutyl)cyclohexan-1-one
- DTXSID60787784
- 55110-12-8
-
- Inchi： 1S/C16H20O2/c1-12(17)15(13-7-3-2-4-8-13)11-14-9-5-6-10-16(14)18/h2-4,7-8,14-15H,5-6,9-11H2,1H3
- InChI Key： BERVZZSYSGFMTG-UHFFFAOYSA-N
- SMILES： O=C1CCCCC1CC(C(C)=O)C1C=CC=CC=1
Computed Properties
- Exact Mass: 244.1464
- Monoisotopic Mass: 244.146329876g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 18
- Rotatable Bond Count: 4
- Complexity: 302
- 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
- XLogP3: 2.7
- Topological Polar Surface Area: 34.1?2
Experimental Properties
- PSA: 34.14
Cyclohexanone, 2-(3-oxo-2-phenylbutyl)- Related Literature
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Mark D. Allendorf,Alauddin Ahmed,Tom Autrey,Jeffrey Camp,Eun Seon Cho,Maciej Haranczyk,Abhi Karkamkar,Di-Jia Liu,Katie R. Meihaus,Iffat H. Nayyar,Roman Nazarov,Donald J. Siegel,Vitalie Stavila,Jeffrey J. Urban,Srimukh Prasad Veccham,Brandon C. Wood Energy Environ. Sci., 2018,11, 2784-2812
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L. Di Michele,D. Fiocco,F. Varrato,E. Eiser,G. Foffi Soft Matter, 2014,10, 3633-3648
-
Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
55110-12-8 (Cyclohexanone, 2-(3-oxo-2-phenylbutyl)-) Related Products
- 34993-51-6((R)-3-Phenyl-cyclohexanone)
- 5910-25-8(3-Phenyl-2,4-pentanedione)
- 4894-75-1(4-phenylcyclohexan-1-one)
- 3506-88-5(3-Benzyl-4-phenylbutan-2-one)
- 493-72-1(5-Phenylcyclohexane-1,3-dione)
- 1444-65-1(2-phenylcyclohexan-1-one)
- 2550-27-8(3-Methyl-4-phenylbutan-2-one)
- 38861-78-8(4-Isobutylacetophenone)
- 2893-05-2(1-Phenyl-3-methyl-2-butanone)
- 5349-62-2(4-Methyl-1-phenyl-2-pentanone)
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