4,4,5,5-tetrafluoropent-1-ene

C5H6F4 — CID 12562972

IUPAC4,4,5,5-tetrafluoropent-1-ene
SMILESC=CCC(F)(F)C(F)F
InChIInChI=1S/C5H6F4/c1-2-3-5(8,9)4(6)7/h2,4H,1,3H2
InChIKeyLZNSFOIEVQSCLG-UHFFFAOYSA-N
MW142.09 g/mol
LogP2.46
Rot. Bonds3

About 4,4,5,5-tetrafluoropent-1-ene

4,4,5,5-tetrafluoropent-1-ene (PubChem CID 12562972) has the molecular formula C5H6F4 and a molecular weight of 142.09 g/mol. Its IUPAC name is 4,4,5,5-tetrafluoropent-1-ene.

Molecular Properties

Compound Name4,4,5,5-tetrafluoropent-1-ene
PubChem CID12562972
Molecular FormulaC5H6F4
Molecular Weight142.09 g/mol
Exact Mass142.04
IUPAC Name4,4,5,5-tetrafluoropent-1-ene
SMILESC=CCC(F)(F)C(F)F
InChIInChI=1S/C5H6F4/c1-2-3-5(8,9)4(6)7/h2,4H,1,3H2
InChIKeyLZNSFOIEVQSCLG-UHFFFAOYSA-N
XLogP2.46
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.09
LogP ≤ 52.46
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 4,4,5,5-tetrafluoropent-1-ene?
The IUPAC name of 4,4,5,5-tetrafluoropent-1-ene (CID 12562972) is 4,4,5,5-tetrafluoropent-1-ene.
What is the SMILES notation for 4,4,5,5-tetrafluoropent-1-ene?
The canonical SMILES for 4,4,5,5-tetrafluoropent-1-ene is C=CCC(F)(F)C(F)F.
What is the InChIKey of 4,4,5,5-tetrafluoropent-1-ene?
The InChIKey is LZNSFOIEVQSCLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6F4/c1-2-3-5(8,9)4(6)7/h2,4H,1,3H2.
What are the key properties of 4,4,5,5-tetrafluoropent-1-ene?
4,4,5,5-tetrafluoropent-1-ene has a molecular weight of 142.09 g/mol, XLogP of 2.46, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4,5,5-tetrafluoropent-1-ene is sourced from PubChem (CID 12562972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).