2-sulfonyl-1,4-bis(2,2,2-trifluoroethoxy)benzene

2-sulfonyl-1,4-bis(2,2,2-trifluoroethoxy)benzene

CAS: 152457-95-9

Formula: C10H8F6O4S

SMILES: FC(F)(F)COC1=CC(=C(OCC(F)(F)F)C=C1)S(=O)=O

IUPAC: 2-sulfonyl-1,4-bis(2,2,2-trifluoroethoxy)benzene

InChI: InChI=1S/C10H8F6O4S/c11-9(12,13)4-19-6-1-2-7(8(3-6)21(17)18)20-5-10(14,15)16/h1-3,21H,4-5H2

Composition: C (35.51%), H (2.38%), F (33.70%), O (18.92%), S (9.48%)

Molar Mass: 338.22

Atom Count: 29

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	338.00474889
Formal Charge	0
FSP3	0.4
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	ORJRLLQJTAPIGQ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	58.74
Topological Polar Surface Area	52.6
Polarizability	22.66
Ring Count	1
Rotatable Bond Count	7

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