1,1,2,3,4,5,5,5-octafluoro-3-(2,2,2-trifluoroethoxy)pent-1-ene

C7H3F11O — CID 10935863

IUPAC1,1,2,3,4,5,5,5-octafluoro-3-(2,2,2-trifluoroethoxy)pent-1-ene
SMILESFC(F)=C(F)C(F)(OCC(F)(F)F)C(F)C(F)(F)F
InChIInChI=1S/C7H3F11O/c8-2(3(9)10)6(15,4(11)7(16,17)18)19-1-5(12,13)14/h4H,1H2
InChIKeyCHEPAQMIBAPVRQ-UHFFFAOYSA-N
MW312.08 g/mol
LogP4.21
Rot. Bonds4

About 1,1,2,3,4,5,5,5-octafluoro-3-(2,2,2-trifluoroethoxy)pent-1-ene

1,1,2,3,4,5,5,5-octafluoro-3-(2,2,2-trifluoroethoxy)pent-1-ene (PubChem CID 10935863) has the molecular formula C7H3F11O and a molecular weight of 312.08 g/mol. Its IUPAC name is 1,1,2,3,4,5,5,5-octafluoro-3-(2,2,2-trifluoroethoxy)pent-1-ene.

Molecular Properties

Compound Name1,1,2,3,4,5,5,5-octafluoro-3-(2,2,2-trifluoroethoxy)pent-1-ene
PubChem CID10935863
Molecular FormulaC7H3F11O
Molecular Weight312.08 g/mol
Exact Mass312.00
IUPAC Name1,1,2,3,4,5,5,5-octafluoro-3-(2,2,2-trifluoroethoxy)pent-1-ene
SMILESFC(F)=C(F)C(F)(OCC(F)(F)F)C(F)C(F)(F)F
InChIInChI=1S/C7H3F11O/c8-2(3(9)10)6(15,4(11)7(16,17)18)19-1-5(12,13)14/h4H,1H2
InChIKeyCHEPAQMIBAPVRQ-UHFFFAOYSA-N
XLogP4.21
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.08
LogP ≤ 54.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,1,2,3,4,5,5,5-octafluoro-3-(2,2,2-trifluoroethoxy)pent-1-ene?
The IUPAC name of 1,1,2,3,4,5,5,5-octafluoro-3-(2,2,2-trifluoroethoxy)pent-1-ene (CID 10935863) is 1,1,2,3,4,5,5,5-octafluoro-3-(2,2,2-trifluoroethoxy)pent-1-ene.
What is the SMILES notation for 1,1,2,3,4,5,5,5-octafluoro-3-(2,2,2-trifluoroethoxy)pent-1-ene?
The canonical SMILES for 1,1,2,3,4,5,5,5-octafluoro-3-(2,2,2-trifluoroethoxy)pent-1-ene is FC(F)=C(F)C(F)(OCC(F)(F)F)C(F)C(F)(F)F.
What is the InChIKey of 1,1,2,3,4,5,5,5-octafluoro-3-(2,2,2-trifluoroethoxy)pent-1-ene?
The InChIKey is CHEPAQMIBAPVRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H3F11O/c8-2(3(9)10)6(15,4(11)7(16,17)18)19-1-5(12,13)14/h4H,1H2.
What are the key properties of 1,1,2,3,4,5,5,5-octafluoro-3-(2,2,2-trifluoroethoxy)pent-1-ene?
1,1,2,3,4,5,5,5-octafluoro-3-(2,2,2-trifluoroethoxy)pent-1-ene has a molecular weight of 312.08 g/mol, XLogP of 4.21, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2,3,4,5,5,5-octafluoro-3-(2,2,2-trifluoroethoxy)pent-1-ene is sourced from PubChem (CID 10935863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).