1,1,1,2,3,3-hexafluoro-3-(fluoromethoxy)-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propoxy]propoxy]propane

C16H2F32O5 — CID 23563840

About 1,1,1,2,3,3-hexafluoro-3-(fluoromethoxy)-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propoxy]propoxy]propane

1,1,1,2,3,3-hexafluoro-3-(fluoromethoxy)-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propoxy]propoxy]propane (PubChem CID 23563840) has the molecular formula C16H2F32O5 and a molecular weight of 882.12 g/mol. Its IUPAC name is 1,1,1,2,3,3-hexafluoro-3-(fluoromethoxy)-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propoxy]propoxy]propane.

Molecular Properties

• Compound Name: 1,1,1,2,3,3-hexafluoro-3-(fluoromethoxy)-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propoxy]propoxy]propane
• PubChem CID: 23563840
• Molecular Formula: C16H2F32O5
• Molecular Weight: 882.12 g/mol
• Exact Mass: 881.94
• IUPAC Name: 1,1,1,2,3,3-hexafluoro-3-(fluoromethoxy)-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propoxy]propoxy]propane
• SMILES: FCOC(F)(F)C(F)(OC(F)(F)C(F)(OC(F)(F)C(F)(OC(F)(F)C(F)(OC(F)(F)C(F)(F)C(F)(F)F)C(F)(F)F)C(F)(F)F)C(F)(F)F)C(F)(F)F
• InChI: InChI=1S/C16H2F32O5/c17-1-49-13(41,42)3(20,8(27,28)29)51-15(45,46)5(22,10(33,34)35)53-16(47,48)6(23,11(36,37)38)52-14(43,44)4(21,9(30,31)32)50-12(39,40)2(18,19)7(24,25)26/h1H2
• InChIKey: DLFGCNRTTIIUJM-UHFFFAOYSA-N
• XLogP: 10.07
• TPSA: 46.15 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 15
• Heavy Atoms: 53
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	882.12
LogP ≤ 5	10.07
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 1,1,1,2,3,3-hexafluoro-3-(fluoromethoxy)-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propoxy]propoxy]propane?

The IUPAC name of 1,1,1,2,3,3-hexafluoro-3-(fluoromethoxy)-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propoxy]propoxy]propane (CID 23563840) is 1,1,1,2,3,3-hexafluoro-3-(fluoromethoxy)-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propoxy]propoxy]propane.

What is the SMILES notation for 1,1,1,2,3,3-hexafluoro-3-(fluoromethoxy)-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propoxy]propoxy]propane?

The canonical SMILES for 1,1,1,2,3,3-hexafluoro-3-(fluoromethoxy)-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propoxy]propoxy]propane is FCOC(F)(F)C(F)(OC(F)(F)C(F)(OC(F)(F)C(F)(OC(F)(F)C(F)(OC(F)(F)C(F)(F)C(F)(F)F)C(F)(F)F)C(F)(F)F)C(F)(F)F)C(F)(F)F.

What is the InChIKey of 1,1,1,2,3,3-hexafluoro-3-(fluoromethoxy)-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propoxy]propoxy]propane?

The InChIKey is DLFGCNRTTIIUJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H2F32O5/c17-1-49-13(41,42)3(20,8(27,28)29)51-15(45,46)5(22,10(33,34)35)53-16(47,48)6(23,11(36,37)38)52-14(43,44)4(21,9(30,31)32)50-12(39,40)2(18,19)7(24,25)26/h1H2.

What are the key properties of 1,1,1,2,3,3-hexafluoro-3-(fluoromethoxy)-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propoxy]propoxy]propane?

1,1,1,2,3,3-hexafluoro-3-(fluoromethoxy)-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propoxy]propoxy]propane has a molecular weight of 882.12 g/mol, XLogP of 10.07, 15 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 1,1,1,2,3,3-hexafluoro-3-(fluoromethoxy)-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propoxy]propoxy]propane is sourced from PubChem (CID 23563840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).