Cas no 4510-37-6 (1-(2,3-Dimethyloxiranyl)ethanone)
4510-37-6 structure
Product Name:1-(2,3-Dimethyloxiranyl)ethanone
CAS No:4510-37-6
MF:C6H10O2
MW:114.142402172089
CID:2856136
PubChem ID:12231415
Update Time:2025-04-21
1-(2,3-Dimethyloxiranyl)ethanone Chemical and Physical Properties
Names and Identifiers
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- SCHEMBL15341640
- trans-2,3-dimethyl-2-acetyloxirane
- 1-(2,3-Dimethyloxiranyl)ethanone
- 4510-37-6
- DTXSID301301456
-
- Inchi: 1S/C6H10O2/c1-4(7)6(3)5(2)8-6/h5H,1-3H3
- InChI Key: RZTHFMYLFRPNKG-UHFFFAOYSA-N
- SMILES: O1C(C)C1(C(C)=O)C
Computed Properties
- Exact Mass: 114.068079557Da
- Monoisotopic Mass: 114.068079557Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 8
- Rotatable Bond Count: 1
- Complexity: 130
- 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: 0.3
- Topological Polar Surface Area: 29.6?2
1-(2,3-Dimethyloxiranyl)ethanone Related Literature
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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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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Jianyao Huang,Dong Gao,Zhihui Chen,Weifeng Zhang Polym. Chem., 2021,12, 2471-2480
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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