4,5,5,5-tetrafluoropenta-1,3-diene

C5H4F4 — CID 57144953

IUPAC4,5,5,5-tetrafluoropenta-1,3-diene
SMILESC=CC=C(F)C(F)(F)F
InChIInChI=1S/C5H4F4/c1-2-3-4(6)5(7,8)9/h2-3H,1H2
InChIKeyRQYXZBWFHXKHEA-UHFFFAOYSA-N
MW140.08 g/mol
LogP2.59
Rot. Bonds1

About 4,5,5,5-tetrafluoropenta-1,3-diene

4,5,5,5-tetrafluoropenta-1,3-diene (PubChem CID 57144953) has the molecular formula C5H4F4 and a molecular weight of 140.08 g/mol. Its IUPAC name is 4,5,5,5-tetrafluoropenta-1,3-diene.

Molecular Properties

Compound Name4,5,5,5-tetrafluoropenta-1,3-diene
PubChem CID57144953
Molecular FormulaC5H4F4
Molecular Weight140.08 g/mol
Exact Mass140.02
IUPAC Name4,5,5,5-tetrafluoropenta-1,3-diene
SMILESC=CC=C(F)C(F)(F)F
InChIInChI=1S/C5H4F4/c1-2-3-4(6)5(7,8)9/h2-3H,1H2
InChIKeyRQYXZBWFHXKHEA-UHFFFAOYSA-N
XLogP2.59
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.08
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4,5,5,5-tetrafluoropenta-1,3-diene?
The IUPAC name of 4,5,5,5-tetrafluoropenta-1,3-diene (CID 57144953) is 4,5,5,5-tetrafluoropenta-1,3-diene.
What is the SMILES notation for 4,5,5,5-tetrafluoropenta-1,3-diene?
The canonical SMILES for 4,5,5,5-tetrafluoropenta-1,3-diene is C=CC=C(F)C(F)(F)F.
What is the InChIKey of 4,5,5,5-tetrafluoropenta-1,3-diene?
The InChIKey is RQYXZBWFHXKHEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H4F4/c1-2-3-4(6)5(7,8)9/h2-3H,1H2.
What are the key properties of 4,5,5,5-tetrafluoropenta-1,3-diene?
4,5,5,5-tetrafluoropenta-1,3-diene has a molecular weight of 140.08 g/mol, XLogP of 2.59, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5,5,5-tetrafluoropenta-1,3-diene is sourced from PubChem (CID 57144953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).