3,3,3-trifluoropropyl trifluoromethanesulfonate

3,3,3-trifluoropropyl trifluoromethanesulfonate

CAS: 120097-63-4

Formula: C4H4F6O3S

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

IUPAC: 3,3,3-trifluoropropyl trifluoromethanesulfonate

InChI: InChI=1S/C4H4F6O3S/c5-3(6,7)1-2-13-14(11,12)4(8,9)10/h1-2H2

Composition: C (19.52%), H (1.64%), F (46.31%), O (19.50%), S (13.03%)

Molar Mass: 246.12

Atom Count: 18

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	245.978534141
Formal Charge	0
FSP3	1
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	CFROLHNCACAAOW-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	31.37
Topological Polar Surface Area	43.37
Polarizability	13.06
Ring Count	0
Rotatable Bond Count	5

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