2-[2-[2-[2-(2-decoxy-1-fluoroethoxy)-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethanol

C20H25F17O6 — CID 22639314

About 2-[2-[2-[2-(2-decoxy-1-fluoroethoxy)-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethanol

2-[2-[2-[2-(2-decoxy-1-fluoroethoxy)-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethanol (PubChem CID 22639314) has the molecular formula C20H25F17O6 and a molecular weight of 684.38 g/mol. Its IUPAC name is 2-[2-[2-[2-(2-decoxy-1-fluoroethoxy)-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethanol.

Molecular Properties

• Compound Name: 2-[2-[2-[2-(2-decoxy-1-fluoroethoxy)-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethanol
• PubChem CID: 22639314
• Molecular Formula: C20H25F17O6
• Molecular Weight: 684.38 g/mol
• Exact Mass: 684.14
• IUPAC Name: 2-[2-[2-[2-(2-decoxy-1-fluoroethoxy)-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethanol
• SMILES: CCCCCCCCCCOCC(F)OC(F)(F)C(F)(F)OC(F)(F)C(F)(F)OC(F)(F)C(F)(F)OC(F)(F)C(O)(F)F
• InChI: InChI=1S/C20H25F17O6/c1-2-3-4-5-6-7-8-9-10-39-11-12(21)40-15(26,27)16(28,29)42-19(34,35)20(36,37)43-18(32,33)17(30,31)41-14(24,25)13(22,23)38/h12,38H,2-11H2,1H3
• InChIKey: OQJNGZRXBOPYOG-UHFFFAOYSA-N
• XLogP: 8.24
• TPSA: 66.38 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 23
• Heavy Atoms: 43
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	684.38
LogP ≤ 5	8.24
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-[2-(2-decoxy-1-fluoroethoxy)-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethanol?

The IUPAC name of 2-[2-[2-[2-(2-decoxy-1-fluoroethoxy)-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethanol (CID 22639314) is 2-[2-[2-[2-(2-decoxy-1-fluoroethoxy)-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethanol.

What is the SMILES notation for 2-[2-[2-[2-(2-decoxy-1-fluoroethoxy)-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethanol?

The canonical SMILES for 2-[2-[2-[2-(2-decoxy-1-fluoroethoxy)-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethanol is CCCCCCCCCCOCC(F)OC(F)(F)C(F)(F)OC(F)(F)C(F)(F)OC(F)(F)C(F)(F)OC(F)(F)C(O)(F)F.

What is the InChIKey of 2-[2-[2-[2-(2-decoxy-1-fluoroethoxy)-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethanol?

The InChIKey is OQJNGZRXBOPYOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25F17O6/c1-2-3-4-5-6-7-8-9-10-39-11-12(21)40-15(26,27)16(28,29)42-19(34,35)20(36,37)43-18(32,33)17(30,31)41-14(24,25)13(22,23)38/h12,38H,2-11H2,1H3.

What are the key properties of 2-[2-[2-[2-(2-decoxy-1-fluoroethoxy)-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethanol?

2-[2-[2-[2-(2-decoxy-1-fluoroethoxy)-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethanol has a molecular weight of 684.38 g/mol, XLogP of 8.24, 23 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[2-[2-[2-(2-decoxy-1-fluoroethoxy)-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethanol is sourced from PubChem (CID 22639314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).