2-[2-[1,2-difluoro-2-(1,1,2,2-tetrafluoro-2-fluorosulfonylethoxy)ethenoxy]-1,2-difluoroethenoxy]-1,1,2,2-tetrafluoroethanesulfonyl fluoride

C8F14O7S2 — CID 87176225

About 2-[2-[1,2-difluoro-2-(1,1,2,2-tetrafluoro-2-fluorosulfonylethoxy)ethenoxy]-1,2-difluoroethenoxy]-1,1,2,2-tetrafluoroethanesulfonyl fluoride

2-[2-[1,2-difluoro-2-(1,1,2,2-tetrafluoro-2-fluorosulfonylethoxy)ethenoxy]-1,2-difluoroethenoxy]-1,1,2,2-tetrafluoroethanesulfonyl fluoride (PubChem CID 87176225) has the molecular formula C8F14O7S2 and a molecular weight of 538.19 g/mol. Its IUPAC name is 2-[2-[1,2-difluoro-2-(1,1,2,2-tetrafluoro-2-fluorosulfonylethoxy)ethenoxy]-1,2-difluoroethenoxy]-1,1,2,2-tetrafluoroethanesulfonyl fluoride.

Molecular Properties

• Compound Name: 2-[2-[1,2-difluoro-2-(1,1,2,2-tetrafluoro-2-fluorosulfonylethoxy)ethenoxy]-1,2-difluoroethenoxy]-1,1,2,2-tetrafluoroethanesulfonyl fluoride
• PubChem CID: 87176225
• Molecular Formula: C8F14O7S2
• Molecular Weight: 538.19 g/mol
• Exact Mass: 537.89
• IUPAC Name: 2-[2-[1,2-difluoro-2-(1,1,2,2-tetrafluoro-2-fluorosulfonylethoxy)ethenoxy]-1,2-difluoroethenoxy]-1,1,2,2-tetrafluoroethanesulfonyl fluoride
• SMILES: O=S(=O)(F)C(F)(F)C(F)(F)OC(F)=C(F)OC(F)=C(F)OC(F)(F)C(F)(F)S(=O)(=O)F
• InChI: InChI=1S/C8F14O7S2/c9-1(3(11)28-5(13,14)7(17,18)30(21,23)24)27-2(10)4(12)29-6(15,16)8(19,20)31(22,25)26
• InChIKey: YBAWAJAVAIZXGK-UHFFFAOYSA-N
• XLogP: 4.14
• TPSA: 95.97 Ų
• H-Bond Acceptors: 7
• Rotatable Bonds: 10
• Heavy Atoms: 31
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	538.19
LogP ≤ 5	4.14
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	7

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-[2-[1,2-difluoro-2-(1,1,2,2-tetrafluoro-2-fluorosulfonylethoxy)ethenoxy]-1,2-difluoroethenoxy]-1,1,2,2-tetrafluoroethanesulfonyl fluoride?

The IUPAC name of 2-[2-[1,2-difluoro-2-(1,1,2,2-tetrafluoro-2-fluorosulfonylethoxy)ethenoxy]-1,2-difluoroethenoxy]-1,1,2,2-tetrafluoroethanesulfonyl fluoride (CID 87176225) is 2-[2-[1,2-difluoro-2-(1,1,2,2-tetrafluoro-2-fluorosulfonylethoxy)ethenoxy]-1,2-difluoroethenoxy]-1,1,2,2-tetrafluoroethanesulfonyl fluoride.

What is the SMILES notation for 2-[2-[1,2-difluoro-2-(1,1,2,2-tetrafluoro-2-fluorosulfonylethoxy)ethenoxy]-1,2-difluoroethenoxy]-1,1,2,2-tetrafluoroethanesulfonyl fluoride?

The canonical SMILES for 2-[2-[1,2-difluoro-2-(1,1,2,2-tetrafluoro-2-fluorosulfonylethoxy)ethenoxy]-1,2-difluoroethenoxy]-1,1,2,2-tetrafluoroethanesulfonyl fluoride is O=S(=O)(F)C(F)(F)C(F)(F)OC(F)=C(F)OC(F)=C(F)OC(F)(F)C(F)(F)S(=O)(=O)F.

What is the InChIKey of 2-[2-[1,2-difluoro-2-(1,1,2,2-tetrafluoro-2-fluorosulfonylethoxy)ethenoxy]-1,2-difluoroethenoxy]-1,1,2,2-tetrafluoroethanesulfonyl fluoride?

The InChIKey is YBAWAJAVAIZXGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8F14O7S2/c9-1(3(11)28-5(13,14)7(17,18)30(21,23)24)27-2(10)4(12)29-6(15,16)8(19,20)31(22,25)26.

What are the key properties of 2-[2-[1,2-difluoro-2-(1,1,2,2-tetrafluoro-2-fluorosulfonylethoxy)ethenoxy]-1,2-difluoroethenoxy]-1,1,2,2-tetrafluoroethanesulfonyl fluoride?

2-[2-[1,2-difluoro-2-(1,1,2,2-tetrafluoro-2-fluorosulfonylethoxy)ethenoxy]-1,2-difluoroethenoxy]-1,1,2,2-tetrafluoroethanesulfonyl fluoride has a molecular weight of 538.19 g/mol, XLogP of 4.14, 10 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[2-[1,2-difluoro-2-(1,1,2,2-tetrafluoro-2-fluorosulfonylethoxy)ethenoxy]-1,2-difluoroethenoxy]-1,1,2,2-tetrafluoroethanesulfonyl fluoride is sourced from PubChem (CID 87176225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).