1,1,2,2-tetrafluoro-2-(1,1,2,2-tetrafluoroethoxy)ethanesulfonyl chloride

C4HClF8O3S — CID 13141609

IUPAC1,1,2,2-tetrafluoro-2-(1,1,2,2-tetrafluoroethoxy)ethanesulfonyl chloride
SMILESO=S(=O)(Cl)C(F)(F)C(F)(F)OC(F)(F)C(F)F
InChIInChI=1S/C4HClF8O3S/c5-17(14,15)4(12,13)3(10,11)16-2(8,9)1(6)7/h1H
InChIKeyDSYPZTCBVCBYCF-UHFFFAOYSA-N
MW316.55 g/mol
LogP2.62
Rot. Bonds5

About 1,1,2,2-tetrafluoro-2-(1,1,2,2-tetrafluoroethoxy)ethanesulfonyl chloride

1,1,2,2-tetrafluoro-2-(1,1,2,2-tetrafluoroethoxy)ethanesulfonyl chloride (PubChem CID 13141609) has the molecular formula C4HClF8O3S and a molecular weight of 316.55 g/mol. Its IUPAC name is 1,1,2,2-tetrafluoro-2-(1,1,2,2-tetrafluoroethoxy)ethanesulfonyl chloride.

Molecular Properties

Compound Name1,1,2,2-tetrafluoro-2-(1,1,2,2-tetrafluoroethoxy)ethanesulfonyl chloride
PubChem CID13141609
Molecular FormulaC4HClF8O3S
Molecular Weight316.55 g/mol
Exact Mass315.92
IUPAC Name1,1,2,2-tetrafluoro-2-(1,1,2,2-tetrafluoroethoxy)ethanesulfonyl chloride
SMILESO=S(=O)(Cl)C(F)(F)C(F)(F)OC(F)(F)C(F)F
InChIInChI=1S/C4HClF8O3S/c5-17(14,15)4(12,13)3(10,11)16-2(8,9)1(6)7/h1H
InChIKeyDSYPZTCBVCBYCF-UHFFFAOYSA-N
XLogP2.62
TPSA43.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.55
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1,1,2,2-tetrafluoro-2-(1,1,2,2-tetrafluoroethoxy)ethanesulfonyl chloride?
The IUPAC name of 1,1,2,2-tetrafluoro-2-(1,1,2,2-tetrafluoroethoxy)ethanesulfonyl chloride (CID 13141609) is 1,1,2,2-tetrafluoro-2-(1,1,2,2-tetrafluoroethoxy)ethanesulfonyl chloride.
What is the SMILES notation for 1,1,2,2-tetrafluoro-2-(1,1,2,2-tetrafluoroethoxy)ethanesulfonyl chloride?
The canonical SMILES for 1,1,2,2-tetrafluoro-2-(1,1,2,2-tetrafluoroethoxy)ethanesulfonyl chloride is O=S(=O)(Cl)C(F)(F)C(F)(F)OC(F)(F)C(F)F.
What is the InChIKey of 1,1,2,2-tetrafluoro-2-(1,1,2,2-tetrafluoroethoxy)ethanesulfonyl chloride?
The InChIKey is DSYPZTCBVCBYCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C4HClF8O3S/c5-17(14,15)4(12,13)3(10,11)16-2(8,9)1(6)7/h1H.
What are the key properties of 1,1,2,2-tetrafluoro-2-(1,1,2,2-tetrafluoroethoxy)ethanesulfonyl chloride?
1,1,2,2-tetrafluoro-2-(1,1,2,2-tetrafluoroethoxy)ethanesulfonyl chloride has a molecular weight of 316.55 g/mol, XLogP of 2.62, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2,2-tetrafluoro-2-(1,1,2,2-tetrafluoroethoxy)ethanesulfonyl chloride is sourced from PubChem (CID 13141609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).