1,3,3,4,4,5,5-heptafluoro-2-(2,2,3,3-tetrafluoropropoxy)cyclopentene

C8H3F11O — CID 155670508

IUPAC1,3,3,4,4,5,5-heptafluoro-2-(2,2,3,3-tetrafluoropropoxy)cyclopentene
SMILESFC1=C(OCC(F)(F)C(F)F)C(F)(F)C(F)(F)C1(F)F
InChIInChI=1S/C8H3F11O/c9-2-3(20-1-5(12,13)4(10)11)7(16,17)8(18,19)6(2,14)15/h4H,1H2
InChIKeyAECBZZCFIPLXGD-UHFFFAOYSA-N
MW324.09 g/mol
LogP4.00
Rot. Bonds4

About 1,3,3,4,4,5,5-heptafluoro-2-(2,2,3,3-tetrafluoropropoxy)cyclopentene

1,3,3,4,4,5,5-heptafluoro-2-(2,2,3,3-tetrafluoropropoxy)cyclopentene (PubChem CID 155670508) has the molecular formula C8H3F11O and a molecular weight of 324.09 g/mol. Its IUPAC name is 1,3,3,4,4,5,5-heptafluoro-2-(2,2,3,3-tetrafluoropropoxy)cyclopentene.

Molecular Properties

Compound Name1,3,3,4,4,5,5-heptafluoro-2-(2,2,3,3-tetrafluoropropoxy)cyclopentene
PubChem CID155670508
Molecular FormulaC8H3F11O
Molecular Weight324.09 g/mol
Exact Mass324.00
IUPAC Name1,3,3,4,4,5,5-heptafluoro-2-(2,2,3,3-tetrafluoropropoxy)cyclopentene
SMILESFC1=C(OCC(F)(F)C(F)F)C(F)(F)C(F)(F)C1(F)F
InChIInChI=1S/C8H3F11O/c9-2-3(20-1-5(12,13)4(10)11)7(16,17)8(18,19)6(2,14)15/h4H,1H2
InChIKeyAECBZZCFIPLXGD-UHFFFAOYSA-N
XLogP4.00
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.09
LogP ≤ 54.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 1,3,3,4,4,5,5-heptafluoro-2-(2,2,3,3-tetrafluoropropoxy)cyclopentene 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 1,3,3,4,4,5,5-heptafluoro-2-(2,2,3,3-tetrafluoropropoxy)cyclopentene?
The IUPAC name of 1,3,3,4,4,5,5-heptafluoro-2-(2,2,3,3-tetrafluoropropoxy)cyclopentene (CID 155670508) is 1,3,3,4,4,5,5-heptafluoro-2-(2,2,3,3-tetrafluoropropoxy)cyclopentene.
What is the SMILES notation for 1,3,3,4,4,5,5-heptafluoro-2-(2,2,3,3-tetrafluoropropoxy)cyclopentene?
The canonical SMILES for 1,3,3,4,4,5,5-heptafluoro-2-(2,2,3,3-tetrafluoropropoxy)cyclopentene is FC1=C(OCC(F)(F)C(F)F)C(F)(F)C(F)(F)C1(F)F.
What is the InChIKey of 1,3,3,4,4,5,5-heptafluoro-2-(2,2,3,3-tetrafluoropropoxy)cyclopentene?
The InChIKey is AECBZZCFIPLXGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H3F11O/c9-2-3(20-1-5(12,13)4(10)11)7(16,17)8(18,19)6(2,14)15/h4H,1H2.
What are the key properties of 1,3,3,4,4,5,5-heptafluoro-2-(2,2,3,3-tetrafluoropropoxy)cyclopentene?
1,3,3,4,4,5,5-heptafluoro-2-(2,2,3,3-tetrafluoropropoxy)cyclopentene has a molecular weight of 324.09 g/mol, XLogP of 4.00, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,3,4,4,5,5-heptafluoro-2-(2,2,3,3-tetrafluoropropoxy)cyclopentene is sourced from PubChem (CID 155670508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).