1,3,3,4,4-pentafluoro-2-(1,1,2,2,2-pentafluoroethyl)cyclobutene

C6F10 — CID 12842338

IUPAC1,3,3,4,4-pentafluoro-2-(1,1,2,2,2-pentafluoroethyl)cyclobutene
SMILESFC1=C(C(F)(F)C(F)(F)F)C(F)(F)C1(F)F
InChIInChI=1S/C6F10/c7-2-1(3(8,9)5(2,12)13)4(10,11)6(14,15)16
InChIKeyNXHQVQZLTRXACX-UHFFFAOYSA-N
MW262.05 g/mol
LogP3.69
Rot. Bonds1

About 1,3,3,4,4-pentafluoro-2-(1,1,2,2,2-pentafluoroethyl)cyclobutene

1,3,3,4,4-pentafluoro-2-(1,1,2,2,2-pentafluoroethyl)cyclobutene (PubChem CID 12842338) has the molecular formula C6F10 and a molecular weight of 262.05 g/mol. Its IUPAC name is 1,3,3,4,4-pentafluoro-2-(1,1,2,2,2-pentafluoroethyl)cyclobutene.

Molecular Properties

Compound Name1,3,3,4,4-pentafluoro-2-(1,1,2,2,2-pentafluoroethyl)cyclobutene
PubChem CID12842338
Molecular FormulaC6F10
Molecular Weight262.05 g/mol
Exact Mass261.98
IUPAC Name1,3,3,4,4-pentafluoro-2-(1,1,2,2,2-pentafluoroethyl)cyclobutene
SMILESFC1=C(C(F)(F)C(F)(F)F)C(F)(F)C1(F)F
InChIInChI=1S/C6F10/c7-2-1(3(8,9)5(2,12)13)4(10,11)6(14,15)16
InChIKeyNXHQVQZLTRXACX-UHFFFAOYSA-N
XLogP3.69
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.05
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 1,3,3,4,4-pentafluoro-2-(1,1,2,2,2-pentafluoroethyl)cyclobutene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1,3,3,4,4-pentafluoro-2-(1,1,2,2,2-pentafluoroethyl)cyclobutene?
The IUPAC name of 1,3,3,4,4-pentafluoro-2-(1,1,2,2,2-pentafluoroethyl)cyclobutene (CID 12842338) is 1,3,3,4,4-pentafluoro-2-(1,1,2,2,2-pentafluoroethyl)cyclobutene.
What is the SMILES notation for 1,3,3,4,4-pentafluoro-2-(1,1,2,2,2-pentafluoroethyl)cyclobutene?
The canonical SMILES for 1,3,3,4,4-pentafluoro-2-(1,1,2,2,2-pentafluoroethyl)cyclobutene is FC1=C(C(F)(F)C(F)(F)F)C(F)(F)C1(F)F.
What is the InChIKey of 1,3,3,4,4-pentafluoro-2-(1,1,2,2,2-pentafluoroethyl)cyclobutene?
The InChIKey is NXHQVQZLTRXACX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6F10/c7-2-1(3(8,9)5(2,12)13)4(10,11)6(14,15)16.
What are the key properties of 1,3,3,4,4-pentafluoro-2-(1,1,2,2,2-pentafluoroethyl)cyclobutene?
1,3,3,4,4-pentafluoro-2-(1,1,2,2,2-pentafluoroethyl)cyclobutene has a molecular weight of 262.05 g/mol, XLogP of 3.69, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,3,4,4-pentafluoro-2-(1,1,2,2,2-pentafluoroethyl)cyclobutene is sourced from PubChem (CID 12842338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).