(E)-1,1,1,4,4,5,5,5-octafluoropent-2-ene

C5H2F8 — CID 18520951

IUPAC(E)-1,1,1,4,4,5,5,5-octafluoropent-2-ene
SMILESFC(F)(F)/C=C/C(F)(F)C(F)(F)F
InChIInChI=1S/C5H2F8/c6-3(7,5(11,12)13)1-2-4(8,9)10/h1-2H/b2-1+
InChIKeyCVMVAHSMKGITAV-OWOJBTEDSA-N
MW214.06 g/mol
LogP3.30
Rot. Bonds1

About (E)-1,1,1,4,4,5,5,5-octafluoropent-2-ene

(E)-1,1,1,4,4,5,5,5-octafluoropent-2-ene (PubChem CID 18520951) has the molecular formula C5H2F8 and a molecular weight of 214.06 g/mol. Its IUPAC name is (E)-1,1,1,4,4,5,5,5-octafluoropent-2-ene.

Molecular Properties

Compound Name(E)-1,1,1,4,4,5,5,5-octafluoropent-2-ene
PubChem CID18520951
Molecular FormulaC5H2F8
Molecular Weight214.06 g/mol
Exact Mass214.00
IUPAC Name(E)-1,1,1,4,4,5,5,5-octafluoropent-2-ene
SMILESFC(F)(F)/C=C/C(F)(F)C(F)(F)F
InChIInChI=1S/C5H2F8/c6-3(7,5(11,12)13)1-2-4(8,9)10/h1-2H/b2-1+
InChIKeyCVMVAHSMKGITAV-OWOJBTEDSA-N
XLogP3.30
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.06
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (E)-1,1,1,4,4,5,5,5-octafluoropent-2-ene?
The IUPAC name of (E)-1,1,1,4,4,5,5,5-octafluoropent-2-ene (CID 18520951) is (E)-1,1,1,4,4,5,5,5-octafluoropent-2-ene.
What is the SMILES notation for (E)-1,1,1,4,4,5,5,5-octafluoropent-2-ene?
The canonical SMILES for (E)-1,1,1,4,4,5,5,5-octafluoropent-2-ene is FC(F)(F)/C=C/C(F)(F)C(F)(F)F.
What is the InChIKey of (E)-1,1,1,4,4,5,5,5-octafluoropent-2-ene?
The InChIKey is CVMVAHSMKGITAV-OWOJBTEDSA-N. The full InChI is InChI=1S/C5H2F8/c6-3(7,5(11,12)13)1-2-4(8,9)10/h1-2H/b2-1+.
What are the key properties of (E)-1,1,1,4,4,5,5,5-octafluoropent-2-ene?
(E)-1,1,1,4,4,5,5,5-octafluoropent-2-ene has a molecular weight of 214.06 g/mol, XLogP of 3.30, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1,1,1,4,4,5,5,5-octafluoropent-2-ene is sourced from PubChem (CID 18520951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).