1,1,2,3,4,4,5,5,5-nonafluoro-1-(1,1,2,3,4,4,5,5,5-nonafluoropent-2-enoxy)pent-2-ene

C10F18O — CID 141460580

IUPAC1,1,2,3,4,4,5,5,5-nonafluoro-1-(1,1,2,3,4,4,5,5,5-nonafluoropent-2-enoxy)pent-2-ene
SMILESFC(=C(F)C(F)(F)C(F)(F)F)C(F)(F)OC(F)(F)C(F)=C(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C10F18O/c11-1(5(15,16)9(23,24)25)3(13)7(19,20)29-8(21,22)4(14)2(12)6(17,18)10(26,27)28
InChIKeyWJIQAINLJIYUOX-UHFFFAOYSA-N
MW478.07 g/mol
LogP6.89
Rot. Bonds6

About 1,1,2,3,4,4,5,5,5-nonafluoro-1-(1,1,2,3,4,4,5,5,5-nonafluoropent-2-enoxy)pent-2-ene

1,1,2,3,4,4,5,5,5-nonafluoro-1-(1,1,2,3,4,4,5,5,5-nonafluoropent-2-enoxy)pent-2-ene (PubChem CID 141460580) has the molecular formula C10F18O and a molecular weight of 478.07 g/mol. Its IUPAC name is 1,1,2,3,4,4,5,5,5-nonafluoro-1-(1,1,2,3,4,4,5,5,5-nonafluoropent-2-enoxy)pent-2-ene.

Molecular Properties

Compound Name1,1,2,3,4,4,5,5,5-nonafluoro-1-(1,1,2,3,4,4,5,5,5-nonafluoropent-2-enoxy)pent-2-ene
PubChem CID141460580
Molecular FormulaC10F18O
Molecular Weight478.07 g/mol
Exact Mass477.97
IUPAC Name1,1,2,3,4,4,5,5,5-nonafluoro-1-(1,1,2,3,4,4,5,5,5-nonafluoropent-2-enoxy)pent-2-ene
SMILESFC(=C(F)C(F)(F)C(F)(F)F)C(F)(F)OC(F)(F)C(F)=C(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C10F18O/c11-1(5(15,16)9(23,24)25)3(13)7(19,20)29-8(21,22)4(14)2(12)6(17,18)10(26,27)28
InChIKeyWJIQAINLJIYUOX-UHFFFAOYSA-N
XLogP6.89
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500478.07
LogP ≤ 56.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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1,1,1,2,2,3,3,4,4,5,6,7,7,8,8,9,9,10,10,11,11,12,12,12-tetracosafluorododec-5-ene
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1,1,1,3,4,5,5,6,6,6-decafluorohex-3-en-2-one
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1,1,2,2,3,3,4,4,5,5,6,6-dodecafluoro-1,6-bis(1,1,2,3,3-pentafluoroprop-2-enoxy)hexane
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1,1,1,3,4,4,5,5,5-nonafluoro-2-(2,2,2-trifluoroethoxy)pent-2-ene
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Frequently Asked Questions

What is the IUPAC name of 1,1,2,3,4,4,5,5,5-nonafluoro-1-(1,1,2,3,4,4,5,5,5-nonafluoropent-2-enoxy)pent-2-ene?
The IUPAC name of 1,1,2,3,4,4,5,5,5-nonafluoro-1-(1,1,2,3,4,4,5,5,5-nonafluoropent-2-enoxy)pent-2-ene (CID 141460580) is 1,1,2,3,4,4,5,5,5-nonafluoro-1-(1,1,2,3,4,4,5,5,5-nonafluoropent-2-enoxy)pent-2-ene.
What is the SMILES notation for 1,1,2,3,4,4,5,5,5-nonafluoro-1-(1,1,2,3,4,4,5,5,5-nonafluoropent-2-enoxy)pent-2-ene?
The canonical SMILES for 1,1,2,3,4,4,5,5,5-nonafluoro-1-(1,1,2,3,4,4,5,5,5-nonafluoropent-2-enoxy)pent-2-ene is FC(=C(F)C(F)(F)C(F)(F)F)C(F)(F)OC(F)(F)C(F)=C(F)C(F)(F)C(F)(F)F.
What is the InChIKey of 1,1,2,3,4,4,5,5,5-nonafluoro-1-(1,1,2,3,4,4,5,5,5-nonafluoropent-2-enoxy)pent-2-ene?
The InChIKey is WJIQAINLJIYUOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10F18O/c11-1(5(15,16)9(23,24)25)3(13)7(19,20)29-8(21,22)4(14)2(12)6(17,18)10(26,27)28.
What are the key properties of 1,1,2,3,4,4,5,5,5-nonafluoro-1-(1,1,2,3,4,4,5,5,5-nonafluoropent-2-enoxy)pent-2-ene?
1,1,2,3,4,4,5,5,5-nonafluoro-1-(1,1,2,3,4,4,5,5,5-nonafluoropent-2-enoxy)pent-2-ene has a molecular weight of 478.07 g/mol, XLogP of 6.89, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2,3,4,4,5,5,5-nonafluoro-1-(1,1,2,3,4,4,5,5,5-nonafluoropent-2-enoxy)pent-2-ene is sourced from PubChem (CID 141460580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).