Cas no 51849-73-1 (2(3H)-Furanone,dihydro-5,5-dimethyl-3-(phenylmethyl)-)
51849-73-1 structure
Product Name:2(3H)-Furanone,dihydro-5,5-dimethyl-3-(phenylmethyl)-
CAS No:51849-73-1
MF:C13H16O2
MW:204.264944076538
CID:381758
PubChem ID:302111
Update Time:2025-04-19
2(3H)-Furanone,dihydro-5,5-dimethyl-3-(phenylmethyl)- Chemical and Physical Properties
Names and Identifiers
-
- 2(3H)-Furanone,dihydro-5,5-dimethyl-3-(phenylmethyl)-
- 3-benzyl-5,5-dimethyloxolan-2-one
- NSC-184760
- 3-Benzyl-5,5-dimethyltetrahydrofuran-2-one
- 51849-73-1
- DTXSID30306961
- NSC184760
-
- Inchi： 1S/C13H16O2/c1-13(2)9-11(12(14)15-13)8-10-6-4-3-5-7-10/h3-7,11H,8-9H2,1-2H3
- InChI Key： PYHHNUZYJVNRMX-UHFFFAOYSA-N
- SMILES： O1C(C(CC2C=CC=CC=2)CC1(C)C)=O
Computed Properties
- Exact Mass: 204.11508
- Monoisotopic Mass: 204.115
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 239
- 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: 2.8
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- Density: 1.058
- Boiling Point: 331.9°Cat760mmHg
- Flash Point: 137.4°C
- Refractive Index: 1.52
- PSA: 26.3
2(3H)-Furanone,dihydro-5,5-dimethyl-3-(phenylmethyl)- 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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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
51849-73-1 (2(3H)-Furanone,dihydro-5,5-dimethyl-3-(phenylmethyl)-) Related Products
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