1,2,3,4,5-pentafluorocyclopenta-1,3-diene

C5F5+ — CID 14024640

IUPAC1,2,3,4,5-pentafluorocyclopenta-1,3-diene
SMILESFC1=C(F)[C+](F)C(F)=C1F
InChIInChI=1S/C5F5/c6-1-2(7)4(9)5(10)3(1)8/q+1
InChIKeyLVIVRWIINPTMTJ-UHFFFAOYSA-N
MW155.04 g/mol
LogP2.80
Rot. Bonds

About 1,2,3,4,5-pentafluorocyclopenta-1,3-diene

1,2,3,4,5-pentafluorocyclopenta-1,3-diene (PubChem CID 14024640) has the molecular formula C5F5+ and a molecular weight of 155.04 g/mol. Its IUPAC name is 1,2,3,4,5-pentafluorocyclopenta-1,3-diene.

Molecular Properties

Compound Name1,2,3,4,5-pentafluorocyclopenta-1,3-diene
PubChem CID14024640
Molecular FormulaC5F5+
Molecular Weight155.04 g/mol
Exact Mass154.99
IUPAC Name1,2,3,4,5-pentafluorocyclopenta-1,3-diene
SMILESFC1=C(F)[C+](F)C(F)=C1F
InChIInChI=1S/C5F5/c6-1-2(7)4(9)5(10)3(1)8/q+1
InChIKeyLVIVRWIINPTMTJ-UHFFFAOYSA-N
XLogP2.80
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.04
LogP ≤ 52.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,2,3,4,5-pentafluorocyclopenta-1,3-diene?
The IUPAC name of 1,2,3,4,5-pentafluorocyclopenta-1,3-diene (CID 14024640) is 1,2,3,4,5-pentafluorocyclopenta-1,3-diene.
What is the SMILES notation for 1,2,3,4,5-pentafluorocyclopenta-1,3-diene?
The canonical SMILES for 1,2,3,4,5-pentafluorocyclopenta-1,3-diene is FC1=C(F)[C+](F)C(F)=C1F.
What is the InChIKey of 1,2,3,4,5-pentafluorocyclopenta-1,3-diene?
The InChIKey is LVIVRWIINPTMTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5F5/c6-1-2(7)4(9)5(10)3(1)8/q+1.
What are the key properties of 1,2,3,4,5-pentafluorocyclopenta-1,3-diene?
1,2,3,4,5-pentafluorocyclopenta-1,3-diene has a molecular weight of 155.04 g/mol, XLogP of 2.80, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,4,5-pentafluorocyclopenta-1,3-diene is sourced from PubChem (CID 14024640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).