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2-(trifluoromethoxy)ethyl trifluoromethanesulfonate

2-(trifluoromethoxy)ethyl trifluoromethanesulfonate

CAS: 329710-76-1

Formula: C4H4F6O4S

SMILES: FC(F)(F)OCCOS(=O)(=O)C(F)(F)F

IUPAC: 2-(trifluoromethoxy)ethyl trifluoromethanesulfonate

InChI: InChI=1S/C4H4F6O4S/c5-3(6,7)13-1-2-14-15(11,12)4(8,9)10/h1-2H2

Composition: C (18.33%), H (1.54%), F (43.49%), O (24.41%), S (12.23%)

Molar Mass: 262.12

Atom Count: 19

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 261.973448761
Formal Charge 0
FSP3 1
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey XNNJMXBWUMKLRR-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 29.11
Topological Polar Surface Area 52.6
Polarizability 13.9
Ring Count 0
Rotatable Bond Count 6

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Purity LeadTime CAS PacketSize UnitPrice
97% <14 Days 329710-76-1 $283.50-$425.25$283.50$425.25
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