Cas no 220432-35-9 (2(3H)-Furanone,3,3-difluorodihydro-4-(1-methylethyl)-)
220432-35-9 structure
Product Name:2(3H)-Furanone,3,3-difluorodihydro-4-(1-methylethyl)-
CAS No:220432-35-9
MF:C7H10F2O2
MW:164.149909496307
CID:243935
PubChem ID:10535010
Update Time:2025-04-19
2(3H)-Furanone,3,3-difluorodihydro-4-(1-methylethyl)- Chemical and Physical Properties
Names and Identifiers
-
- 2(3H)-Furanone,3,3-difluorodihydro-4-(1-methylethyl)-
- 2(3H)-Furanone,3,3-difluorodihydro-4-(1-methylethyl)-(9CI)
- 220432-35-9
- 3,3-Difluoro-4-Isopropyldihydro-2(3H)-Furanone
-
- Inchi： 1S/C7H10F2O2/c1-4(2)5-3-11-6(10)7(5,8)9/h4-5H,3H2,1-2H3
- InChI Key： ZVOLFZHIWLZSKN-UHFFFAOYSA-N
- SMILES： FC1(C(=O)OCC1C(C)C)F
Computed Properties
- Exact Mass: 164.0649
- Monoisotopic Mass: 164.06488588g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 177
- 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: 26.3?2
Experimental Properties
- PSA: 26.3
2(3H)-Furanone,3,3-difluorodihydro-4-(1-methylethyl)- Related Literature
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Jadwiga Frelek,Marcin Górecki,Marta ?aszcz,Agata Suszczyńska,Elemér Vass,Wojciech J. Szczepek Chem. Commun., 2012,48, 5295-5297
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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5. 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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