Cas no 72242-66-1 (2,5-Furandione, dihydro-3-(2,4,4-trimethyl-2-pentenyl)-)
72242-66-1 structure
Product Name:2,5-Furandione, dihydro-3-(2,4,4-trimethyl-2-pentenyl)-
CAS No:72242-66-1
MF:C12H18O3
MW:210.269524097443
CID:544279
PubChem ID:71404464
Update Time:2025-04-19
2,5-Furandione, dihydro-3-(2,4,4-trimethyl-2-pentenyl)- Chemical and Physical Properties
Names and Identifiers
-
- 2,5-Furandione, dihydro-3-(2,4,4-trimethyl-2-pentenyl)-
- 3-(2,4,4-trimethylpent-2-enyl)oxolane-2,5-dione
- DTXSID50825306
- 3-(2,4,4-Trimethylpent-2-en-1-yl)oxolane-2,5-dione
- 72242-66-1
-
- Inchi： 1S/C12H18O3/c1-8(7-12(2,3)4)5-9-6-10(13)15-11(9)14/h7,9H,5-6H2,1-4H3
- InChI Key： TVRJIXCIWRQYNL-UHFFFAOYSA-N
- SMILES： O1C(CC(C1=O)CC(C)=CC(C)(C)C)=O
Computed Properties
- Exact Mass: 210.12564
- Monoisotopic Mass: 210.125594432g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 3
- Complexity: 307
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 1
- XLogP3: 2.8
- Topological Polar Surface Area: 43.4?2
Experimental Properties
- PSA: 43.37
2,5-Furandione, dihydro-3-(2,4,4-trimethyl-2-pentenyl)- Related Literature
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Julia M. Yeomans Soft Matter, 2010,6, 703-704
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Goonay Yousefalizadeh,Shideh Ahmadi,Nicholas J. Mosey,Kevin G. Stamplecoskie Nanoscale, 2021,13, 242-252
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3. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Dongjia Han,Bing Xue,Juan Du,Tomohiro Miyatake,Hitoshi Tamiaki,Xin Xing,Wei Yuan,Yanyan Li Phys. Chem. Chem. Phys., 2016,18, 24252-24260
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Jadwiga Frelek,Marcin Górecki,Marta ?aszcz,Agata Suszczyńska,Elemér Vass,Wojciech J. Szczepek Chem. Commun., 2012,48, 5295-5297
72242-66-1 (2,5-Furandione, dihydro-3-(2,4,4-trimethyl-2-pentenyl)-) Related Products
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