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4,5,5,5-tetrafluoro-4-(trifluoromethoxy)pentan-2-one

4,5,5,5-tetrafluoro-4-(trifluoromethoxy)pentan-2-one

CAS: 261760-18-3

Formula: C6H5F7O2

SMILES: CC(=O)CC(F)(OC(F)(F)F)C(F)(F)F

IUPAC: 4,5,5,5-tetrafluoro-4-(trifluoromethoxy)pentan-2-one

InChI: InChI=1/C6H5F7O2/c1-3(14)2-4(7,5(8,9)10)15-6(11,12)13/h2H2,1H3

Composition: C (29.77%), H (2.08%), F (54.93%), O (13.22%)

Molar Mass: 242.093

Atom Count: 20

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 242.017776542
Formal Charge 0
FSP3 0.83
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey HBCCWHHGCKXNAB-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 29.16
Topological Polar Surface Area 26.3
Polarizability 12.46
Ring Count 0
Rotatable Bond Count 5

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