Cas no 220294-24-6 (2(3H)-Furanone,4-ethyl-3,3-difluorodihydro-)
220294-24-6 structure
Product Name:2(3H)-Furanone,4-ethyl-3,3-difluorodihydro-
CAS No:220294-24-6
MF:C6H8F2O2
MW:150.123329162598
CID:243889
Update Time:2024-01-26
2(3H)-Furanone,4-ethyl-3,3-difluorodihydro- Chemical and Physical Properties
Names and Identifiers
-
- 2(3H)-Furanone,4-ethyl-3,3-difluorodihydro-
- 2(3H)-Furanone,4-ethyl-3,3-difluorodihydro-(9CI)
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- Inchi: 1S/C6H8F2O2/c1-2-4-3-10-5(9)6(4,7)8/h4H,2-3H2,1H3
- InChI Key: ZUWIBGBHHHZUQA-UHFFFAOYSA-N
- SMILES: O1CC(CC)C(F)(F)C1=O
Computed Properties
- Exact Mass: 150.04924
- Monoisotopic Mass: 150.049
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 10
- Rotatable Bond Count: 1
- Complexity: 156
- 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
- Topological Polar Surface Area: 26.3A^2
Experimental Properties
- PSA: 26.3
2(3H)-Furanone,4-ethyl-3,3-difluorodihydro- Related Literature
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Benjamin Gabriel Poulson,Kacper Szczepski,Joanna Izabela Lachowicz,Lukasz Jaremko,Abdul-Hamid Emwas,Mariusz Jaremko RSC Adv., 2020,10, 215-227
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Sandip Gangadhar Balwe,Yeon Tae Jeong Org. Biomol. Chem., 2018,16, 1287-1296
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Felix Witte,Philipp Rietsch,Nithiya Nirmalananthan-Budau,Florian Weigert,Jan P. G?tze,Ute Resch-Genger,Siegfried Eigler,Beate Paulus Phys. Chem. Chem. Phys., 2021,23, 17521-17529
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Christian K. Rank,Alexander W. Jones,Tatjana Wall,Patrick Di Martino-Fumo,Sarah Schr?ck,Markus Gerhards,Frederic W. Patureau Chem. Commun., 2019,55, 13749-13752
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