Catalog | OFC174744184 |
CAS | 174744-18-4 |
Category | Fluorinated Lactones |
Synonyms | 2-Oxo-3-(trifluoromethyl)tetrahydrofuran; 3-(Trifluoromethyl)oxolan-2-one, alpha-(Trifluoromethyl)-gamma-butyrolactone |
MDL Number | MFCD00798462 |
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IUPAC Name | 3-(trifluoromethyl)oxolan-2-one |
InChI | InChI=1S/C5H5F3O2/c6-5(7,8)3-1-2-10-4(3)9/h3H,1-2H2 |
InChI Key | QNGJRLKMHRKJJL-UHFFFAOYSA-N |
Isomeric SMILES | C1COC(=O)C1C(F)(F)F |
EC Number | 806-654-0 |
Molecular Formula | C5H5F3O2 |
Molecular Weight | 154.09 |
XLogP3-AA | 1.3 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 5 |
Rotatable Bond Count | 0 |
Exact Mass | 154.02416388 g/mol |
Monoisotopic Mass | 154.02416388 g/mol |
Topological Polar Surface Area | 26.3Ų |
Heavy Atom Count | 10 |
Formal Charge | 0 |
Complexity | 152 |
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