1,1,1,4,5,5,5-heptafluoro-2-[2-[1,1,1,4,5,5,5-heptafluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4-(trifluoromethyl)pent-2-en-2-yl]oxyethoxy]-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4-(trifluoromethyl)pent-2-ene

C20H4F34O2 — CID 58623571

About 1,1,1,4,5,5,5-heptafluoro-2-[2-[1,1,1,4,5,5,5-heptafluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4-(trifluoromethyl)pent-2-en-2-yl]oxyethoxy]-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4-(trifluoromethyl)pent-2-ene

1,1,1,4,5,5,5-heptafluoro-2-[2-[1,1,1,4,5,5,5-heptafluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4-(trifluoromethyl)pent-2-en-2-yl]oxyethoxy]-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4-(trifluoromethyl)pent-2-ene (PubChem CID 58623571) has the molecular formula C20H4F34O2 and a molecular weight of 922.18 g/mol. Its IUPAC name is 1,1,1,4,5,5,5-heptafluoro-2-[2-[1,1,1,4,5,5,5-heptafluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4-(trifluoromethyl)pent-2-en-2-yl]oxyethoxy]-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4-(trifluoromethyl)pent-2-ene.

Molecular Properties

• Compound Name: 1,1,1,4,5,5,5-heptafluoro-2-[2-[1,1,1,4,5,5,5-heptafluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4-(trifluoromethyl)pent-2-en-2-yl]oxyethoxy]-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4-(trifluoromethyl)pent-2-ene
• PubChem CID: 58623571
• Molecular Formula: C20H4F34O2
• Molecular Weight: 922.18 g/mol
• Exact Mass: 921.97
• IUPAC Name: 1,1,1,4,5,5,5-heptafluoro-2-[2-[1,1,1,4,5,5,5-heptafluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4-(trifluoromethyl)pent-2-en-2-yl]oxyethoxy]-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4-(trifluoromethyl)pent-2-ene
• SMILES: FC(F)(F)C(OCCOC(=C(C(F)(C(F)(F)F)C(F)(F)F)C(F)(C(F)(F)F)C(F)(F)F)C(F)(F)F)=C(C(F)(C(F)(F)F)C(F)(F)F)C(F)(C(F)(F)F)C(F)(F)F
• InChI: InChI=1S/C20H4F34O2/c21-7(13(31,32)33,14(34,35)36)3(8(22,15(37,38)39)16(40,41)42)5(11(25,26)27)55-1-2-56-6(12(28,29)30)4(9(23,17(43,44)45)18(46,47)48)10(24,19(49,50)51)20(52,53)54/h1-2H2
• InChIKey: GIQGFSRYBDEGEQ-UHFFFAOYSA-N
• XLogP: 11.98
• TPSA: 18.46 Ų
• H-Bond Acceptors: 2
• Rotatable Bonds: 9
• Heavy Atoms: 56
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	922.18
LogP ≤ 5	11.98
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 1,1,1,4,5,5,5-heptafluoro-2-[2-[1,1,1,4,5,5,5-heptafluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4-(trifluoromethyl)pent-2-en-2-yl]oxyethoxy]-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4-(trifluoromethyl)pent-2-ene?

The IUPAC name of 1,1,1,4,5,5,5-heptafluoro-2-[2-[1,1,1,4,5,5,5-heptafluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4-(trifluoromethyl)pent-2-en-2-yl]oxyethoxy]-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4-(trifluoromethyl)pent-2-ene (CID 58623571) is 1,1,1,4,5,5,5-heptafluoro-2-[2-[1,1,1,4,5,5,5-heptafluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4-(trifluoromethyl)pent-2-en-2-yl]oxyethoxy]-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4-(trifluoromethyl)pent-2-ene.

What is the SMILES notation for 1,1,1,4,5,5,5-heptafluoro-2-[2-[1,1,1,4,5,5,5-heptafluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4-(trifluoromethyl)pent-2-en-2-yl]oxyethoxy]-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4-(trifluoromethyl)pent-2-ene?

The canonical SMILES for 1,1,1,4,5,5,5-heptafluoro-2-[2-[1,1,1,4,5,5,5-heptafluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4-(trifluoromethyl)pent-2-en-2-yl]oxyethoxy]-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4-(trifluoromethyl)pent-2-ene is FC(F)(F)C(OCCOC(=C(C(F)(C(F)(F)F)C(F)(F)F)C(F)(C(F)(F)F)C(F)(F)F)C(F)(F)F)=C(C(F)(C(F)(F)F)C(F)(F)F)C(F)(C(F)(F)F)C(F)(F)F.

What is the InChIKey of 1,1,1,4,5,5,5-heptafluoro-2-[2-[1,1,1,4,5,5,5-heptafluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4-(trifluoromethyl)pent-2-en-2-yl]oxyethoxy]-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4-(trifluoromethyl)pent-2-ene?

The InChIKey is GIQGFSRYBDEGEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H4F34O2/c21-7(13(31,32)33,14(34,35)36)3(8(22,15(37,38)39)16(40,41)42)5(11(25,26)27)55-1-2-56-6(12(28,29)30)4(9(23,17(43,44)45)18(46,47)48)10(24,19(49,50)51)20(52,53)54/h1-2H2.

What are the key properties of 1,1,1,4,5,5,5-heptafluoro-2-[2-[1,1,1,4,5,5,5-heptafluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4-(trifluoromethyl)pent-2-en-2-yl]oxyethoxy]-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4-(trifluoromethyl)pent-2-ene?

1,1,1,4,5,5,5-heptafluoro-2-[2-[1,1,1,4,5,5,5-heptafluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4-(trifluoromethyl)pent-2-en-2-yl]oxyethoxy]-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4-(trifluoromethyl)pent-2-ene has a molecular weight of 922.18 g/mol, XLogP of 11.98, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for 1,1,1,4,5,5,5-heptafluoro-2-[2-[1,1,1,4,5,5,5-heptafluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4-(trifluoromethyl)pent-2-en-2-yl]oxyethoxy]-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-4-(trifluoromethyl)pent-2-ene is sourced from PubChem (CID 58623571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).